ethyl 2-[3-(4-methoxyphenyl)sulfanylpropanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(4-methoxyphenyl)sulfanylpropanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-methoxyphenyl)sulfanylpropanoylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[3-[(4-methoxyphenyl)thio]-1-oxopropyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-methoxyphenyl)sulfanylpropanoylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[3-[(4-methoxyphenyl)thio]propanoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H23NO4S2 MolecularWeight: 393.52022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CCSC2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CCSC2=CC=C(C=C2)OC

InChI

InChI=1S/C19H23NO4S2/c1-5-24-19(22)17-12(2)13(3)26-18(17)20-16(21)10-11-25-15-8-6-14(23-4)7-9-15/h6-9H,5,10-11H2,1-4H3,(H,20,21)