ethyl 2-[2-(4-acetamidophenyl)sulfanylethanoylamino]-4-cyclopropyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-acetamidophenyl)sulfanylethanoylamino]-4-cyclopropyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-acetamidophenyl)sulfanylacetyl]amino]-4-cyclopropyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(4-acetamidophenyl)thio]-1-oxoethyl]amino]-4-cyclopropyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-acetamidophenyl)sulfanylacetyl]amino]-4-cyclopropylthiophene-3-carboxylate Traditional Name: 2-[[2-[(4-acetamidophenyl)thio]acetyl]amino]-4-cyclopropyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CSC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CSC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C20H22N2O4S2/c1-3-26-20(25)18-16(13-4-5-13)10-28-19(18)22-17(24)11-27-15-8-6-14(7-9-15)21-12(2)23/h6-10,13H,3-5,11H2,1-2H3,(H,21,23)(H,22,24)