[1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 5-(2,2-dimethylpropanoylamino)-3-methyl-thiophene-2-carboxylate

Systemtic Name: [1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 5-(2,2-dimethylpropanoylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: [1-methyl-2-(2-methylanilino)-2-oxo-ethyl] 5-(2,2-dimethylpropanoylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 5-[(2,2-dimethyl-1-oxopropyl)amino]-3-methyl-2-thiophenecarboxylic acid [1-(2-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylanilino)-1-oxopropan-2-yl] 5-(2,2-dimethylpropanoylamino)-3-methylthiophene-2-carboxylate Traditional Name: 3-methyl-5-(pivaloylamino)thiophene-2-carboxylic acid [2-keto-1-methyl-2-(o-toluidino)ethyl] ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)OC(=O)C2=C(C=C(S2)NC(=O)C(C)(C)C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C(C)OC(=O)C2=C(C=C(S2)NC(=O)C(C)(C)C)C

InChI

InChI=1S/C21H26N2O4S/c1-12-9-7-8-10-15(12)22-18(24)14(3)27-19(25)17-13(2)11-16(28-17)23-20(26)21(4,5)6/h7-11,14H,1-6H3,(H,22,24)(H,23,26)