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

Systemtic Name: methyl 3-methyl-5-(propan-2-ylcarbamothioylamino)thiophene-2-carboxylate Openeye Name: methyl 5-(isopropylcarbamothioylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 3-methyl-5-[[(propan-2-ylamino)-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-5-(propan-2-ylcarbamothioylamino)thiophene-2-carboxylate Traditional Name: 5-(isopropylthiocarbamoylamino)-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C11H16N2O2S2 MolecularWeight: 272.38694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=S)NC(C)C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1)NC(=S)NC(C)C)C(=O)OC

InChI

InChI=1S/C11H16N2O2S2/c1-6(2)12-11(16)13-8-5-7(3)9(17-8)10(14)15-4/h5-6H,1-4H3,(H2,12,13,16)