dimethyl 3-methyl-5-[(2,4,6-trimethylphenyl)carbamothioylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[(2,4,6-trimethylphenyl)carbamothioylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[(2,4,6-trimethylphenyl)carbamothioylamino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[sulfanylidene-(2,4,6-trimethylanilino)methyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[(2,4,6-trimethylphenyl)carbamothioylamino]thiophene-2,4-dicarboxylate Traditional Name: 5-(mesitylthiocarbamoylamino)-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C19H22N2O4S2 MolecularWeight: 406.51898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=S)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=S)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC)C

InChI

InChI=1S/C19H22N2O4S2/c1-9-7-10(2)14(11(3)8-9)20-19(26)21-16-13(17(22)24-5)12(4)15(27-16)18(23)25-6/h7-8H,1-6H3,(H2,20,21,26)