methyl 2-[1-(1,3-dimethylpyrazol-4-yl)ethylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[1-(1,3-dimethylpyrazol-4-yl)ethylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[1-(1,3-dimethylpyrazol-4-yl)ethylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[1-(1,3-dimethyl-4-pyrazolyl)ethylamino]-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[1-(1,3-dimethylpyrazol-4-yl)ethylcarbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[1-(1,3-dimethylpyrazol-4-yl)ethylthiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C16H22N4O2S2 MolecularWeight: 366.50148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NC(C)C2=CN(N=C2C)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NC(C)C2=CN(N=C2C)C)C

InChI

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