3-bromanyl-8-methyl-6-piperazin-1-yl-5H-benzo[b][1,4]benzodiazepine

Systemtic Name: 3-bromanyl-8-methyl-6-piperazin-1-yl-5H-benzo[b][1,4]benzodiazepine Openeye Name: 3-bromo-8-methyl-6-piperazin-1-yl-5H-benzo[b][1,4]benzodiazepine CAS Name: 3-bromo-8-methyl-6-(1-piperazinyl)-5H-benzo[b][1,4]benzodiazepine IUPAC Name: 3-bromo-8-methyl-6-piperazin-1-yl-5H-benzo[b][1,4]benzodiazepine Traditional Name: 3-bromo-8-methyl-6-piperazino-5H-benzo[b][1,4]benzodiazepine Formula: C18H19BrN4 MolecularWeight: 371.27426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(NC3=C(C=CC(=C3)Br)N=C2C=C1)N4CCNCC4

Isomeric SMILES

CC1=CC2=C(NC3=C(C=CC(=C3)Br)N=C2C=C1)N4CCNCC4

InChI

InChI=1S/C18H19BrN4/c1-12-2-4-15-14(10-12)18(23-8-6-20-7-9-23)22-17-11-13(19)3-5-16(17)21-15/h2-5,10-11,20,22H,6-9H2,1H3