methyl 4-ethyl-5-methyl-2-[(2,4,6-trimethylphenyl)carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-ethyl-5-methyl-2-[(2,4,6-trimethylphenyl)carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 4-ethyl-5-methyl-2-[(2,4,6-trimethylphenyl)carbamothioylamino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[sulfanylidene-(2,4,6-trimethylanilino)methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-ethyl-5-methyl-2-[(2,4,6-trimethylphenyl)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 4-ethyl-2-(mesitylthiocarbamoylamino)-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C19H24N2O2S2 MolecularWeight: 376.53606

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)NC(=S)NC2=C(C=C(C=C2C)C)C)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)NC(=S)NC2=C(C=C(C=C2C)C)C)C

InChI

InChI=1S/C19H24N2O2S2/c1-7-14-13(5)25-17(15(14)18(22)23-6)21-19(24)20-16-11(3)8-10(2)9-12(16)4/h8-9H,7H2,1-6H3,(H2,20,21,24)