8-chloranyl-6-(4-cyclohexylpiperazin-1-yl)-11H-pyrido[2,3-b][1,4]benzodiazepine

Systemtic Name: 8-chloranyl-6-(4-cyclohexylpiperazin-1-yl)-11H-pyrido[2,3-b][1,4]benzodiazepine Openeye Name: 8-chloro-6-(4-cyclohexylpiperazin-1-yl)-11H-pyrido[2,3-b][1,4]benzodiazepine CAS Name: 8-chloro-6-(4-cyclohexyl-1-piperazinyl)-11H-pyrido[2,3-b][1,4]benzodiazepine IUPAC Name: 8-chloro-6-(4-cyclohexylpiperazin-1-yl)-11H-pyrido[2,3-b][1,4]benzodiazepine Traditional Name: 8-chloro-6-(4-cyclohexylpiperazino)-11H-pyrido[2,3-b][1,4]benzodiazepine Formula: C22H26ClN5 MolecularWeight: 395.92834

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C3=NC4=C(NC5=C3C=C(C=C5)Cl)N=CC=C4

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C3=NC4=C(NC5=C3C=C(C=C5)Cl)N=CC=C4

InChI

InChI=1S/C22H26ClN5/c23-16-8-9-19-18(15-16)22(26-20-7-4-10-24-21(20)25-19)28-13-11-27(12-14-28)17-5-2-1-3-6-17/h4,7-10,15,17H,1-3,5-6,11-14H2,(H,24,25)