methyl 5-ethyl-2-[1-(4-methylphenyl)propylcarbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-ethyl-2-[1-(4-methylphenyl)propylcarbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-ethyl-2-[1-(p-tolyl)propylcarbamothioylamino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[[1-(4-methylphenyl)propylamino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-[1-(4-methylphenyl)propylcarbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[1-(p-tolyl)propylthiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C19H24N2O2S2 MolecularWeight: 376.53606

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)NC(CC)C2=CC=C(C=C2)C)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)NC(CC)C2=CC=C(C=C2)C)C(=O)OC

InChI

InChI=1S/C19H24N2O2S2/c1-5-14-11-15(18(22)23-4)17(25-14)21-19(24)20-16(6-2)13-9-7-12(3)8-10-13/h7-11,16H,5-6H2,1-4H3,(H2,20,21,24)