methyl 2-(3,3-dimethylbutanoylamino)-4-(3,4-dimethylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-(3,3-dimethylbutanoylamino)-4-(3,4-dimethylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-(3,3-dimethylbutanoylamino)-4-(3,4-dimethylphenyl)thiophene-3-carboxylate CAS Name: 2-[(3,3-dimethyl-1-oxobutyl)amino]-4-(3,4-dimethylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(3,3-dimethylbutanoylamino)-4-(3,4-dimethylphenyl)thiophene-3-carboxylate Traditional Name: 2-(3,3-dimethylbutanoylamino)-4-(3,4-dimethylphenyl)thiophene-3-carboxylic acid methyl ester Formula: C20H25NO3S MolecularWeight: 359.4824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CC(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CC(C)(C)C)C

InChI

InChI=1S/C20H25NO3S/c1-12-7-8-14(9-13(12)2)15-11-25-18(17(15)19(23)24-6)21-16(22)10-20(3,4)5/h7-9,11H,10H2,1-6H3,(H,21,22)