dimethyl 3-methyl-5-(2-methylbutan-2-ylcarbamothioylamino)thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-(2-methylbutan-2-ylcarbamothioylamino)thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-(1,1-dimethylpropylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(2-methylbutan-2-ylamino)-sulfanylidenemethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-(2-methylbutan-2-ylcarbamothioylamino)thiophene-2,4-dicarboxylate Traditional Name: 5-(tert-amylthiocarbamoylamino)-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C15H22N2O4S2 MolecularWeight: 358.47618

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=S)NC1=C(C(=C(S1)C(=O)OC)C)C(=O)OC

Isomeric SMILES

CCC(C)(C)NC(=S)NC1=C(C(=C(S1)C(=O)OC)C)C(=O)OC

InChI

InChI=1S/C15H22N2O4S2/c1-7-15(3,4)17-14(22)16-11-9(12(18)20-5)8(2)10(23-11)13(19)21-6/h7H2,1-6H3,(H2,16,17,22)