methyl 2-[(1-ethylpyrazol-4-yl)methylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(1-ethylpyrazol-4-yl)methylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(1-ethylpyrazol-4-yl)methylcarbamothioylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[[(1-ethyl-4-pyrazolyl)methylamino]-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(1-ethylpyrazol-4-yl)methylcarbamothioylamino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(1-ethylpyrazol-4-yl)methylthiocarbamoylamino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C14H18N4O2S2 MolecularWeight: 338.44832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N4O2S2/c1-4-18-8-10(7-16-18)6-15-14(21)17-12-11(13(19)20-3)5-9(2)22-12/h5,7-8H,4,6H2,1-3H3,(H2,15,17,21)