3-methyl-5-[4-(3-methylphenyl)-2-piperidin-4-yl-1H-imidazol-5-yl]-1-(2-methylpropyl)benzimidazol-2-one

Systemtic Name: 3-methyl-5-[4-(3-methylphenyl)-2-piperidin-4-yl-1H-imidazol-5-yl]-1-(2-methylpropyl)benzimidazol-2-one Openeye Name: 1-isobutyl-3-methyl-5-[4-(m-tolyl)-2-(4-piperidyl)-1H-imidazol-5-yl]benzimidazol-2-one CAS Name: 3-methyl-5-[4-(3-methylphenyl)-2-(4-piperidinyl)-1H-imidazol-5-yl]-1-(2-methylpropyl)-2-benzimidazolone IUPAC Name: 3-methyl-5-[4-(3-methylphenyl)-2-piperidin-4-yl-1H-imidazol-5-yl]-1-(2-methylpropyl)benzimidazol-2-one Traditional Name: 1-isobutyl-3-methyl-5-[4-(m-tolyl)-2-(4-piperidyl)-1H-imidazol-5-yl]benzimidazol-2-one Formula: C27H33N5O MolecularWeight: 443.58382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(NC(=N2)C3CCNCC3)C4=CC5=C(C=C4)N(C(=O)N5C)CC(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(NC(=N2)C3CCNCC3)C4=CC5=C(C=C4)N(C(=O)N5C)CC(C)C

InChI

InChI=1S/C27H33N5O/c1-17(2)16-32-22-9-8-21(15-23(22)31(4)27(32)33)25-24(20-7-5-6-18(3)14-20)29-26(30-25)19-10-12-28-13-11-19/h5-9,14-15,17,19,28H,10-13,16H2,1-4H3,(H,29,30)