5-[1-[2-(3-azanylpyrrolidin-1-yl)-2-oxidanylidene-ethyl]-3-(3-methylphenyl)pyrazol-4-yl]-1,3-diethyl-benzimidazol-2-one

Systemtic Name: 5-[1-[2-(3-azanylpyrrolidin-1-yl)-2-oxidanylidene-ethyl]-3-(3-methylphenyl)pyrazol-4-yl]-1,3-diethyl-benzimidazol-2-one Openeye Name: 5-[1-[2-(3-aminopyrrolidin-1-yl)-2-oxo-ethyl]-3-(m-tolyl)pyrazol-4-yl]-1,3-diethyl-benzimidazol-2-one CAS Name: 5-[1-[2-(3-amino-1-pyrrolidinyl)-2-oxoethyl]-3-(3-methylphenyl)-4-pyrazolyl]-1,3-diethyl-2-benzimidazolone IUPAC Name: 5-[1-[2-(3-aminopyrrolidin-1-yl)-2-oxoethyl]-3-(3-methylphenyl)pyrazol-4-yl]-1,3-diethylbenzimidazol-2-one Traditional Name: 5-[1-[2-(3-aminopyrrolidino)-2-keto-ethyl]-3-(m-tolyl)pyrazol-4-yl]-1,3-diethyl-benzimidazol-2-one Formula: C27H32N6O2 MolecularWeight: 472.58198

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C3=CN(N=C3C4=CC(=CC=C4)C)CC(=O)N5CCC(C5)N)N(C1=O)CC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C3=CN(N=C3C4=CC(=CC=C4)C)CC(=O)N5CCC(C5)N)N(C1=O)CC

InChI

InChI=1S/C27H32N6O2/c1-4-32-23-10-9-19(14-24(23)33(5-2)27(32)35)22-16-31(17-25(34)30-12-11-21(28)15-30)29-26(22)20-8-6-7-18(3)13-20/h6-10,13-14,16,21H,4-5,11-12,15,17,28H2,1-3H3