methyl 4-methyl-2-(2-methylpropanoylcarbamothioylamino)-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 4-methyl-2-(2-methylpropanoylcarbamothioylamino)-1,3-thiazole-5-carboxylate Openeye Name: methyl 4-methyl-2-(2-methylpropanoylcarbamothioylamino)thiazole-5-carboxylate CAS Name: 4-methyl-2-[[[(2-methyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-(2-methylpropanoylcarbamothioylamino)-1,3-thiazole-5-carboxylate Traditional Name: 2-(isobutyrylthiocarbamoylamino)-4-methyl-thiazole-5-carboxylic acid methyl ester Formula: C11H15N3O3S2 MolecularWeight: 301.3851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=S)NC(=O)C(C)C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)NC(=S)NC(=O)C(C)C)C(=O)OC

InChI

InChI=1S/C11H15N3O3S2/c1-5(2)8(15)13-10(18)14-11-12-6(3)7(19-11)9(16)17-4/h5H,1-4H3,(H2,12,13,14,15,18)