[1-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl] 3H-benzimidazole-5-carboxylate

Systemtic Name: [1-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl] 3H-benzimidazole-5-carboxylate Openeye Name: [1-methyl-2-oxo-2-[[4-(p-tolyl)thiazol-2-yl]amino]ethyl] 3H-benzimidazole-5-carboxylate CAS Name: 3H-benzimidazole-5-carboxylic acid [1-[[4-(4-methylphenyl)-2-thiazolyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]amino]-1-oxopropan-2-yl] 3H-benzimidazole-5-carboxylate Traditional Name: 3H-benzimidazole-5-carboxylic acid [2-keto-1-methyl-2-[[4-(p-tolyl)thiazol-2-yl]amino]ethyl] ester Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(C)OC(=O)C3=CC4=C(C=C3)N=CN4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(C)OC(=O)C3=CC4=C(C=C3)N=CN4

InChI

InChI=1S/C21H18N4O3S/c1-12-3-5-14(6-4-12)18-10-29-21(24-18)25-19(26)13(2)28-20(27)15-7-8-16-17(9-15)23-11-22-16/h3-11,13H,1-2H3,(H,22,23)(H,24,25,26)