Ethyl (1R,2S)-2-ethenyl-1-[[[(1R,2R,4R)-2-[(5-hexen-1-ylmethylamino)carbonyl]-4-[[7-methoxy-8-methyl-2-[4-(1-methylethyl)-2-thiazolyl]-4-quinolinyl]oxy]cyclopentyl]carbonyl]amino]cyclopropanecarboxylate

CAS Registry Number®

923604-56-2

CAS Name

Ethyl (1R,2S)-2-ethenyl-1-[[[(1R,2R,4R)-2-[(5-hexen-1-ylmethylamino)carbonyl]-4-[[7-methoxy-8-methyl-2-[4-(1-methylethyl)-2-thiazolyl]-4-quinolinyl]oxy]cyclopentyl]carbonyl]amino]cyclopropanecarboxylate

Molecular Formula

C39H50N4O6S

Molecular Mass

702.90

Cite this Page

Ethyl (1R,2S)-2-ethenyl-1-[[[(1R,2R,4R)-2-[(5-hexen-1-ylmethylamino)carbonyl]-4-[[7-methoxy-8-methyl-2-[4-(1-methylethyl)-2-thiazolyl]-4-quinolinyl]oxy]cyclopentyl]carbonyl]amino]cyclopropanecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=923604-56-2 (retrieved 2024-12-02) (CAS RN: 923604-56-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    64.4-67.2 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C39H50N4O6S/c1-9-12-13-14-17-43(7)37(45)29-19-26(18-28(29)35(44)42-39(21-25(39)10-2)38(46)48-11-3)49-33-20-30(36-41-31(22-50-36)23(4)5)40-34-24(6)32(47-8)16-15-27(33)34/h9-10,15-16,20,22-23,25-26,28-29H,1-2,11-14,17-19,21H2,3-8H3,(H,42,44)/t25-,26-,28-,29-,39-/m1/s1

InChIKey

InChIKey=LXIHHJGSYJRKSI-WBRKZUJYSA-N

SMILES

N(C(=O)[C@H]1[C@H](C(N(CCCCC=C)C)=O)C[C@H](OC=2C3=C(N=C(C2)C4=NC(C(C)C)=CS4)C(C)=C(OC)C=C3)C1)[C@@]5(C(OCC)=O)[C@H](C=C)C5

Canonical SMILES

O=C(OCC)C1(NC(=O)C2CC(OC3=CC(=NC=4C3=CC=C(OC)C4C)C5=NC(=CS5)C(C)C)CC2C(=O)N(C)CCCCC=C)CC1C=C

Other Names for this Substance

  • Cyclopropanecarboxylic acid, 2-ethenyl-1-[[[(1R,2R,4R)-2-[(5-hexen-1-ylmethylamino)carbonyl]-4-[[7-methoxy-8-methyl-2-[4-(1-methylethyl)-2-thiazolyl]-4-quinolinyl]oxy]cyclopentyl]carbonyl]amino]-, ethyl ester, (1R,2S)-
  • Ethyl (1R,2S)-2-ethenyl-1-[[[(1R,2R,4R)-2-[(5-hexen-1-ylmethylamino)carbonyl]-4-[[7-methoxy-8-methyl-2-[4-(1-methylethyl)-2-thiazolyl]-4-quinolinyl]oxy]cyclopentyl]carbonyl]amino]cyclopropanecarboxylate

CAS INSIGHTSTM
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