[3-[2-[4-(1H-benzimidazol-2-yl)-1,4-diazepan-1-yl]ethyl]-3-(3,4-dichlorophenyl)pyrrolidin-1-yl]-phenyl-methanone

Systemtic Name: [3-[2-[4-(1H-benzimidazol-2-yl)-1,4-diazepan-1-yl]ethyl]-3-(3,4-dichlorophenyl)pyrrolidin-1-yl]-phenyl-methanone Openeye Name: [3-[2-[4-(1H-benzimidazol-2-yl)-1,4-diazepan-1-yl]ethyl]-3-(3,4-dichlorophenyl)pyrrolidin-1-yl]-phenyl-methanone CAS Name: [3-[2-[4-(1H-benzimidazol-2-yl)-1,4-diazepan-1-yl]ethyl]-3-(3,4-dichlorophenyl)-1-pyrrolidinyl]-phenylmethanone IUPAC Name: [3-[2-[4-(1H-benzimidazol-2-yl)-1,4-diazepan-1-yl]ethyl]-3-(3,4-dichlorophenyl)pyrrolidin-1-yl]-phenylmethanone Traditional Name: [3-[2-[4-(1H-benzimidazol-2-yl)-1,4-diazepan-1-yl]ethyl]-3-(3,4-dichlorophenyl)pyrrolidino]-phenyl-methanone Formula: C31H33Cl2N5O MolecularWeight: 562.53262

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=NC3=CC=CC=C3N2)CCC4(CCN(C4)C(=O)C5=CC=CC=C5)C6=CC(=C(C=C6)Cl)Cl

Isomeric SMILES

C1CN(CCN(C1)C2=NC3=CC=CC=C3N2)CCC4(CCN(C4)C(=O)C5=CC=CC=C5)C6=CC(=C(C=C6)Cl)Cl

InChI

InChI=1S/C31H33Cl2N5O/c32-25-12-11-24(21-26(25)33)31(14-18-38(22-31)29(39)23-7-2-1-3-8-23)13-17-36-15-6-16-37(20-19-36)30-34-27-9-4-5-10-28(27)35-30/h1-5,7-12,21H,6,13-20,22H2,(H,34,35)