methyl 2-(2-chloranylethanoylamino)-5-[(3,5-dimethylphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-(2-chloranylethanoylamino)-5-[(3,5-dimethylphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2-chloroacetyl)amino]-5-[(3,5-dimethylphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate CAS Name: 2-[(2-chloro-1-oxoethyl)amino]-5-[(3,5-dimethylanilino)-oxomethyl]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-chloroacetyl)amino]-5-[(3,5-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate Traditional Name: 2-[(2-chloroacetyl)amino]-5-[(3,5-dimethylphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C18H19ClN2O4S MolecularWeight: 394.87246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2=C(C(=C(S2)NC(=O)CCl)C(=O)OC)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=C(C(=C(S2)NC(=O)CCl)C(=O)OC)C)C

InChI

InChI=1S/C18H19ClN2O4S/c1-9-5-10(2)7-12(6-9)20-16(23)15-11(3)14(18(24)25-4)17(26-15)21-13(22)8-19/h5-7H,8H2,1-4H3,(H,20,23)(H,21,22)