ethyl 2-[(4-chloranyl-2-methyl-pyrazol-3-yl)carbonylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-chloranyl-2-methyl-pyrazol-3-yl)carbonylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(4-chloro-2-methyl-pyrazole-3-carbonyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[[(4-chloro-2-methyl-3-pyrazolyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-chloro-2-methylpyrazole-3-carbonyl)carbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(4-chloro-2-methyl-pyrazole-3-carbonyl)thiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C15H17ClN4O3S2 MolecularWeight: 400.90348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=S)NC(=O)C2=C(C=NN2C)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=S)NC(=O)C2=C(C=NN2C)Cl

InChI

InChI=1S/C15H17ClN4O3S2/c1-5-23-14(22)10-7(2)8(3)25-13(10)19-15(24)18-12(21)11-9(16)6-17-20(11)4/h6H,5H2,1-4H3,(H2,18,19,21,24)