Lotrafiban

CAS Registry Number®

171049-14-2

CAS Name

Lotrafiban

Molecular Formula

C23H32N4O4

Molecular Mass

428.52

Cite this Page

Lotrafiban.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=171049-14-2 (retrieved 2024-10-31) (CAS RN: 171049-14-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C23H32N4O4/c1-26-14-18-12-17(2-3-19(18)25-20(23(26)31)13-21(28)29)22(30)27-10-6-16(7-11-27)15-4-8-24-9-5-15/h2-3,12,15-16,20,24-25H,4-11,13-14H2,1H3,(H,28,29)/t20-/m0/s1

InChIKey

InChIKey=PYZOVVQJTLOHDG-FQEVSTJZSA-N

SMILES

C(=O)(C=1C=C2C(N[C@@H](CC(O)=O)C(=O)N(C)C2)=CC1)N3CCC(CC3)C4CCNCC4

Canonical SMILES

O=C(O)CC1NC2=CC=C(C=C2CN(C1=O)C)C(=O)N3CCC(CC3)C4CCNCC4

Other Names for this Substance

  • 1H-1,4-Benzodiazepine-2-acetic acid, 7-([4,4′-bipiperidin]-1-ylcarbonyl)-2,3,4,5-tetrahydro-4-methyl-3-oxo-, (2S)-
  • 1H-1,4-Benzodiazepine-2-acetic acid, 7-([4,4′-bipiperidin]-1-ylcarbonyl)-2,3,4,5-tetrahydro-4-methyl-3-oxo-, (S)-
  • (2S)-7-([4,4′-Bipiperidin]-1-ylcarbonyl)-2,3,4,5-tetrahydro-4-methyl-3-oxo-1H-1,4-benzodiazepine-2-acetic acid
  • SB 214857
  • Lotrafiban

CAS INSIGHTSTM
Adam Sanford and Orr Ravitz from CAS