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

Systemtic Name: [3-[2-[4-[1-(2-imidazol-1-ylethyl)benzimidazol-2-yl]-1,4-diazepan-1-yl]ethyl]-3-phenyl-pyrrolidin-1-yl]-phenyl-methanone Openeye Name: [3-[2-[4-[1-(2-imidazol-1-ylethyl)benzimidazol-2-yl]-1,4-diazepan-1-yl]ethyl]-3-phenyl-pyrrolidin-1-yl]-phenyl-methanone CAS Name: [3-[2-[4-[1-[2-(1-imidazolyl)ethyl]-2-benzimidazolyl]-1,4-diazepan-1-yl]ethyl]-3-phenyl-1-pyrrolidinyl]-phenylmethanone IUPAC Name: [3-[2-[4-[1-(2-imidazol-1-ylethyl)benzimidazol-2-yl]-1,4-diazepan-1-yl]ethyl]-3-phenylpyrrolidin-1-yl]-phenylmethanone Traditional Name: [3-[2-[4-[1-(2-imidazol-1-ylethyl)benzimidazol-2-yl]-1,4-diazepan-1-yl]ethyl]-3-phenyl-pyrrolidino]-phenyl-methanone Formula: C36H41N7O MolecularWeight: 587.75704

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=NC3=CC=CC=C3N2CCN4C=CN=C4)CCC5(CCN(C5)C(=O)C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1CN(CCN(C1)C2=NC3=CC=CC=C3N2CCN4C=CN=C4)CCC5(CCN(C5)C(=O)C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C36H41N7O/c44-34(30-10-3-1-4-11-30)42-22-17-36(28-42,31-12-5-2-6-13-31)16-21-39-19-9-20-41(26-24-39)35-38-32-14-7-8-15-33(32)43(35)27-25-40-23-18-37-29-40/h1-8,10-15,18,23,29H,9,16-17,19-22,24-28H2