methyl 2-[[(1,5-dimethylpyrazol-4-yl)methyl-methyl-carbamothioyl]amino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(1,5-dimethylpyrazol-4-yl)methyl-methyl-carbamothioyl]amino]-5-ethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(1,5-dimethylpyrazol-4-yl)methyl-methyl-carbamothioyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[[(1,5-dimethyl-4-pyrazolyl)methyl-methylamino]-sulfanylidenemethyl]amino]-5-ethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(1,5-dimethylpyrazol-4-yl)methyl-methylcarbamothioyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[(1,5-dimethylpyrazol-4-yl)methyl-methyl-thiocarbamoyl]amino]-5-ethyl-thiophene-3-carboxylic acid methyl ester Formula: C16H22N4O2S2 MolecularWeight: 366.50148

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)N(C)CC2=C(N(N=C2)C)C)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)N(C)CC2=C(N(N=C2)C)C)C(=O)OC

InChI

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