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

Systemtic Name: [3-(3,4-dichlorophenyl)-3-[2-[4-[1-(2-ethoxyethyl)benzimidazol-2-yl]-1,4-diazepan-1-yl]ethyl]pyrrolidin-1-yl]-[3-(1,2,3,4-tetrazol-1-yl)phenyl]methanone Openeye Name: [3-(3,4-dichlorophenyl)-3-[2-[4-[1-(2-ethoxyethyl)benzimidazol-2-yl]-1,4-diazepan-1-yl]ethyl]pyrrolidin-1-yl]-[3-(tetrazol-1-yl)phenyl]methanone CAS Name: [3-(3,4-dichlorophenyl)-3-[2-[4-[1-(2-ethoxyethyl)-2-benzimidazolyl]-1,4-diazepan-1-yl]ethyl]-1-pyrrolidinyl]-[3-(1-tetrazolyl)phenyl]methanone IUPAC Name: [3-(3,4-dichlorophenyl)-3-[2-[4-[1-(2-ethoxyethyl)benzimidazol-2-yl]-1,4-diazepan-1-yl]ethyl]pyrrolidin-1-yl]-[3-(tetrazol-1-yl)phenyl]methanone Traditional Name: [3-(3,4-dichlorophenyl)-3-[2-[4-[1-(2-ethoxyethyl)benzimidazol-2-yl]-1,4-diazepan-1-yl]ethyl]pyrrolidino]-[3-(tetrazol-1-yl)phenyl]methanone Formula: C36H41Cl2N9O2 MolecularWeight: 702.67584

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=CC=CC=C2N=C1N3CCCN(CC3)CCC4(CCN(C4)C(=O)C5=CC(=CC=C5)N6C=NN=N6)C7=CC(=C(C=C7)Cl)Cl

Isomeric SMILES

CCOCCN1C2=CC=CC=C2N=C1N3CCCN(CC3)CCC4(CCN(C4)C(=O)C5=CC(=CC=C5)N6C=NN=N6)C7=CC(=C(C=C7)Cl)Cl

InChI

InChI=1S/C36H41Cl2N9O2/c1-2-49-22-21-46-33-10-4-3-9-32(33)40-35(46)44-16-6-15-43(19-20-44)17-13-36(28-11-12-30(37)31(38)24-28)14-18-45(25-36)34(48)27-7-5-8-29(23-27)47-26-39-41-42-47/h3-5,7-12,23-24,26H,2,6,13-22,25H2,1H3