methyl 2-[(1-ethyl-5-methyl-pyrazol-4-yl)methylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(1-ethyl-5-methyl-pyrazol-4-yl)methylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(1-ethyl-5-methyl-pyrazol-4-yl)methylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[(1-ethyl-5-methyl-4-pyrazolyl)methylamino]-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(1-ethyl-5-methylpyrazol-4-yl)methylcarbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(1-ethyl-5-methyl-pyrazol-4-yl)methylthiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C16H22N4O2S2 MolecularWeight: 366.50148

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CNC(=S)NC2=C(C(=C(S2)C)C)C(=O)OC)C

Isomeric SMILES

CCN1C(=C(C=N1)CNC(=S)NC2=C(C(=C(S2)C)C)C(=O)OC)C

InChI

InChI=1S/C16H22N4O2S2/c1-6-20-10(3)12(8-18-20)7-17-16(23)19-14-13(15(21)22-5)9(2)11(4)24-14/h8H,6-7H2,1-5H3,(H2,17,19,23)