methyl 2-(2-chloranylethanoylamino)-4-methyl-5-(propylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-(2-chloranylethanoylamino)-4-methyl-5-(propylcarbamoyl)thiophene-3-carboxylate Openeye Name: methyl 2-[(2-chloroacetyl)amino]-4-methyl-5-(propylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[(2-chloro-1-oxoethyl)amino]-4-methyl-5-[oxo(propylamino)methyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-chloroacetyl)amino]-4-methyl-5-(propylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[(2-chloroacetyl)amino]-4-methyl-5-(propylcarbamoyl)thiophene-3-carboxylic acid methyl ester Formula: C13H17ClN2O4S MolecularWeight: 332.80308

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(C(=C(S1)NC(=O)CCl)C(=O)OC)C

Isomeric SMILES

CCCNC(=O)C1=C(C(=C(S1)NC(=O)CCl)C(=O)OC)C

InChI

InChI=1S/C13H17ClN2O4S/c1-4-5-15-11(18)10-7(2)9(13(19)20-3)12(21-10)16-8(17)6-14/h4-6H2,1-3H3,(H,15,18)(H,16,17)