ethyl 4-aminocarbonyl-5-[3-(4-methoxyphenyl)sulfanylpropanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-aminocarbonyl-5-[3-(4-methoxyphenyl)sulfanylpropanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-carbamoyl-5-[3-(4-methoxyphenyl)sulfanylpropanoylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-carbamoyl-5-[[3-[(4-methoxyphenyl)thio]-1-oxopropyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-carbamoyl-5-[3-(4-methoxyphenyl)sulfanylpropanoylamino]-3-methylthiophene-2-carboxylate Traditional Name: 4-carbamoyl-5-[3-[(4-methoxyphenyl)thio]propanoylamino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCSC2=CC=C(C=C2)OC)C(=O)N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCSC2=CC=C(C=C2)OC)C(=O)N)C

InChI

InChI=1S/C19H22N2O5S2/c1-4-26-19(24)16-11(2)15(17(20)23)18(28-16)21-14(22)9-10-27-13-7-5-12(25-3)6-8-13/h5-8H,4,9-10H2,1-3H3,(H2,20,23)(H,21,22)