1,3-diethyl-5-[5-(3-methylphenyl)-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]benzimidazol-2-one

Systemtic Name: 1,3-diethyl-5-[5-(3-methylphenyl)-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]benzimidazol-2-one Openeye Name: 1,3-diethyl-5-[5-(m-tolyl)-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]benzimidazol-2-one CAS Name: 1,3-diethyl-5-[5-(3-methylphenyl)-1-[2-(1-pyrrolidinyl)ethyl]-4-pyrazolyl]-2-benzimidazolone IUPAC Name: 1,3-diethyl-5-[5-(3-methylphenyl)-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]benzimidazol-2-one Traditional Name: 1,3-diethyl-5-[5-(m-tolyl)-1-(2-pyrrolidinoethyl)pyrazol-4-yl]benzimidazol-2-one Formula: C27H33N5O MolecularWeight: 443.58382

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C3=C(N(N=C3)CCN4CCCC4)C5=CC(=CC=C5)C)N(C1=O)CC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C3=C(N(N=C3)CCN4CCCC4)C5=CC(=CC=C5)C)N(C1=O)CC

InChI

InChI=1S/C27H33N5O/c1-4-30-24-12-11-21(18-25(24)31(5-2)27(30)33)23-19-28-32(16-15-29-13-6-7-14-29)26(23)22-10-8-9-20(3)17-22/h8-12,17-19H,4-7,13-16H2,1-3H3