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

Systemtic Name: ethyl 2-[2-(4-methoxyphenyl)ethylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-(4-methoxyphenyl)ethylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[2-(4-methoxyphenyl)ethylamino]-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-methoxyphenyl)ethylcarbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[2-(4-methoxyphenyl)ethylthiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H24N2O3S2 MolecularWeight: 392.53546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=S)NCCC2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=S)NCCC2=CC=C(C=C2)OC

InChI

InChI=1S/C19H24N2O3S2/c1-5-24-18(22)16-12(2)13(3)26-17(16)21-19(25)20-11-10-14-6-8-15(23-4)9-7-14/h6-9H,5,10-11H2,1-4H3,(H2,20,21,25)