ethyl 4-ethyl-5-methyl-2-[(4-methylphenyl)carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-2-[(4-methylphenyl)carbamothioylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-5-methyl-2-(p-tolylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[(4-methylanilino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-methyl-2-[(4-methylphenyl)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-(p-tolylthiocarbamoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C18H22N2O2S2 MolecularWeight: 362.50948

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=S)NC2=CC=C(C=C2)C)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=S)NC2=CC=C(C=C2)C)C

InChI

InChI=1S/C18H22N2O2S2/c1-5-14-12(4)24-16(15(14)17(21)22-6-2)20-18(23)19-13-9-7-11(3)8-10-13/h7-10H,5-6H2,1-4H3,(H2,19,20,23)