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

Systemtic Name: methyl 2-[1-(1-ethyl-5-methyl-pyrazol-4-yl)ethylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[1-(1-ethyl-5-methyl-pyrazol-4-yl)ethylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[[1-(1-ethyl-5-methyl-4-pyrazolyl)ethylamino]-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[1-(1-ethyl-5-methylpyrazol-4-yl)ethylcarbamothioylamino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[1-(1-ethyl-5-methyl-pyrazol-4-yl)ethylthiocarbamoylamino]-5-methyl-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)C(C)NC(=S)NC2=C(C=C(S2)C)C(=O)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4O2S2/c1-6-20-11(4)13(8-17-20)10(3)18-16(23)19-14-12(15(21)22-5)7-9(2)24-14/h7-8,10H,6H2,1-5H3,(H2,18,19,23)