Delavirdine

CAS Registry Number®

136817-59-9

CAS Name

Delavirdine

Molecular Formula

C22H28N6O3S

Molecular Mass

456.56

Cite this Page

Delavirdine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=136817-59-9 (retrieved 2024-11-21) (CAS RN: 136817-59-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    226-228 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C22H28N6O3S/c1-15(2)24-19-5-4-8-23-21(19)27-9-11-28(12-10-27)22(29)20-14-16-13-17(26-32(3,30)31)6-7-18(16)25-20/h4-8,13-15,24-26H,9-12H2,1-3H3

InChIKey

InChIKey=WHBIGIKBNXZKFE-UHFFFAOYSA-N

SMILES

N(C(C)C)C1=C(N=CC=C1)N2CCN(C(=O)C3=CC=4C(N3)=CC=C(NS(C)(=O)=O)C4)CC2

Canonical SMILES

O=C(C1=CC=2C=C(C=CC2N1)NS(=O)(=O)C)N3CCN(C4=NC=CC=C4NC(C)C)CC3

Other Names for this Substance

  • Methanesulfonamide, N-[2-[[4-[3-[(1-methylethyl)amino]-2-pyridinyl]-1-piperazinyl]carbonyl]-1H-indol-5-yl]-
  • Piperazine, 1-[3-[(1-methylethyl)amino]-2-pyridinyl]-4-[[5-[(methylsulfonyl)amino]-1H-indol-2-yl]carbonyl]-
  • N-[2-[[4-[3-[(1-Methylethyl)amino]-2-pyridinyl]-1-piperazinyl]carbonyl]-1H-indol-5-yl]methanesulfonamide
  • U 90152
  • 1-[3-(Isopropylamino)-2-pyridyl]-4-[(5-methanesulfonamidoindol-2-yl)carbonyl]piperazine

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration