7-bromanyl-5-(2-chlorophenyl)-1-[4-(4-phenylpiperazin-1-yl)butyl]-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-bromanyl-5-(2-chlorophenyl)-1-[4-(4-phenylpiperazin-1-yl)butyl]-3H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-5-(2-chlorophenyl)-1-[4-(4-phenylpiperazin-1-yl)butyl]-3H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-5-(2-chlorophenyl)-1-[4-(4-phenyl-1-piperazinyl)butyl]-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-5-(2-chlorophenyl)-1-[4-(4-phenylpiperazin-1-yl)butyl]-3H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-5-(2-chlorophenyl)-1-[4-(4-phenylpiperazino)butyl]-3H-1,4-benzodiazepin-2-one Formula: C29H30BrClN4O MolecularWeight: 565.9317

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C(=O)CN=C(C3=C2C=CC(=C3)Br)C4=CC=CC=C4Cl)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCCN2C(=O)CN=C(C3=C2C=CC(=C3)Br)C4=CC=CC=C4Cl)C5=CC=CC=C5

InChI

InChI=1S/C29H30BrClN4O/c30-22-12-13-27-25(20-22)29(24-10-4-5-11-26(24)31)32-21-28(36)35(27)15-7-6-14-33-16-18-34(19-17-33)23-8-2-1-3-9-23/h1-5,8-13,20H,6-7,14-19,21H2