methyl 2-(butanoylamino)-5-[(3-chloranyl-4-methyl-phenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-(butanoylamino)-5-[(3-chloranyl-4-methyl-phenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-(butanoylamino)-5-[(3-chloro-4-methyl-phenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[(3-chloro-4-methylanilino)-oxomethyl]-4-methyl-2-(1-oxobutylamino)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(butanoylamino)-5-[(3-chloro-4-methylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate Traditional Name: 2-butyramido-5-[(3-chloro-4-methyl-phenyl)carbamoyl]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C19H21ClN2O4S MolecularWeight: 408.89904

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC(=C(C=C2)C)Cl)C)C(=O)OC

Isomeric SMILES

CCCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC(=C(C=C2)C)Cl)C)C(=O)OC

InChI

InChI=1S/C19H21ClN2O4S/c1-5-6-14(23)22-18-15(19(25)26-4)11(3)16(27-18)17(24)21-12-8-7-10(2)13(20)9-12/h7-9H,5-6H2,1-4H3,(H,21,24)(H,22,23)