ethyl 2-[[2-cyclopropyl-6-(dimethylcarbamoyl)-1-methyl-4-oxidanyl-benzimidazol-5-yl]methyl]-3-(2-methylphenyl)-3-oxidanylidene-propanoate

Systemtic Name: ethyl 2-[[2-cyclopropyl-6-(dimethylcarbamoyl)-1-methyl-4-oxidanyl-benzimidazol-5-yl]methyl]-3-(2-methylphenyl)-3-oxidanylidene-propanoate Openeye Name: ethyl 2-[[2-cyclopropyl-6-(dimethylcarbamoyl)-4-hydroxy-1-methyl-benzimidazol-5-yl]methyl]-3-(o-tolyl)-3-oxo-propanoate CAS Name: 2-[[2-cyclopropyl-6-[dimethylamino(oxo)methyl]-4-hydroxy-1-methyl-5-benzimidazolyl]methyl]-3-(2-methylphenyl)-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 2-[[2-cyclopropyl-6-(dimethylcarbamoyl)-4-hydroxy-1-methylbenzimidazol-5-yl]methyl]-3-(2-methylphenyl)-3-oxopropanoate Traditional Name: 2-[[2-cyclopropyl-6-(dimethylcarbamoyl)-4-hydroxy-1-methyl-benzimidazol-5-yl]methyl]-3-keto-3-(o-tolyl)propionic acid ethyl ester Formula: C27H31N3O5 MolecularWeight: 477.55214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C(C2=C(C=C1C(=O)N(C)C)N(C(=N2)C3CC3)C)O)C(=O)C4=CC=CC=C4C

Isomeric SMILES

CCOC(=O)C(CC1=C(C2=C(C=C1C(=O)N(C)C)N(C(=N2)C3CC3)C)O)C(=O)C4=CC=CC=C4C

InChI

InChI=1S/C27H31N3O5/c1-6-35-27(34)20(23(31)17-10-8-7-9-15(17)2)13-18-19(26(33)29(3)4)14-21-22(24(18)32)28-25(30(21)5)16-11-12-16/h7-10,14,16,20,32H,6,11-13H2,1-5H3