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

Systemtic Name: methyl 5-ethyl-2-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-ethyl-2-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)carbamothioylamino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[[(1-ethyl-3,5-dimethyl-4-pyrazolyl)amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-[(1-ethyl-3,5-dimethylpyrazol-4-yl)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)thiocarbamoylamino]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)NC2=C(N(N=C2C)CC)C)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)NC2=C(N(N=C2C)CC)C)C(=O)OC

InChI

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