ethyl 4-ethyl-2-[(4-methoxyphenyl)methylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-2-[(4-methoxyphenyl)methylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-2-[(4-methoxyphenyl)methylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-ethyl-2-[[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-2-[(4-methoxyphenyl)methylcarbamothioylamino]-5-methylthiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-(p-anisylthiocarbamoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C19H24N2O3S2 MolecularWeight: 392.53546

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=S)NCC2=CC=C(C=C2)OC)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=S)NCC2=CC=C(C=C2)OC)C

InChI

InChI=1S/C19H24N2O3S2/c1-5-15-12(3)26-17(16(15)18(22)24-6-2)21-19(25)20-11-13-7-9-14(23-4)10-8-13/h7-10H,5-6,11H2,1-4H3,(H2,20,21,25)