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

Systemtic Name: methyl 4-ethyl-2-[(4-methoxyphenyl)methylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 4-ethyl-2-[(4-methoxyphenyl)methylcarbamothioylamino]-5-methylthiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-(p-anisylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O3S2/c1-5-14-11(2)25-16(15(14)17(21)23-4)20-18(24)19-10-12-6-8-13(22-3)9-7-12/h6-9H,5,10H2,1-4H3,(H2,19,20,24)