ethyl 3-methyl-5-(propan-2-ylcarbamothioylamino)thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-(propan-2-ylcarbamothioylamino)thiophene-2-carboxylate Openeye Name: ethyl 5-(isopropylcarbamothioylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 3-methyl-5-[[(propan-2-ylamino)-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-(propan-2-ylcarbamothioylamino)thiophene-2-carboxylate Traditional Name: 5-(isopropylthiocarbamoylamino)-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C12H18N2O2S2 MolecularWeight: 286.41352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=S)NC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=S)NC(C)C)C

InChI

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