7-chloranyl-1-methyl-5-phenyl-3-[[1-(phenylmethyl)indol-3-yl]methyl]-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-1-methyl-5-phenyl-3-[[1-(phenylmethyl)indol-3-yl]methyl]-3H-1,4-benzodiazepin-2-one Openeye Name: 3-[(1-benzylindol-3-yl)methyl]-7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-1-methyl-5-phenyl-3-[[1-(phenylmethyl)-3-indolyl]methyl]-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-[(1-benzylindol-3-yl)methyl]-7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 3-[(1-benzylindol-3-yl)methyl]-7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C32H26ClN3O MolecularWeight: 504.02134

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)CC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)CC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C32H26ClN3O/c1-35-29-17-16-25(33)19-27(29)31(23-12-6-3-7-13-23)34-28(32(35)37)18-24-21-36(20-22-10-4-2-5-11-22)30-15-9-8-14-26(24)30/h2-17,19,21,28H,18,20H2,1H3