methyl 2-(methylcarbamothioylamino)-4-(2-methylpropyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-(methylcarbamothioylamino)-4-(2-methylpropyl)thiophene-3-carboxylate Openeye Name: methyl 4-isobutyl-2-(methylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 2-[[methylamino(sulfanylidene)methyl]amino]-4-(2-methylpropyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(methylcarbamothioylamino)-4-(2-methylpropyl)thiophene-3-carboxylate Traditional Name: 4-isobutyl-2-(methylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C12H18N2O2S2 MolecularWeight: 286.41352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CSC(=C1C(=O)OC)NC(=S)NC

Isomeric SMILES

CC(C)CC1=CSC(=C1C(=O)OC)NC(=S)NC

InChI

InChI=1S/C12H18N2O2S2/c1-7(2)5-8-6-18-10(14-12(17)13-3)9(8)11(15)16-4/h6-7H,5H2,1-4H3,(H2,13,14,17)