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

Systemtic Name: dimethyl 5-[1-(1-ethyl-5-methyl-pyrazol-4-yl)ethylcarbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[1-(1-ethyl-5-methyl-pyrazol-4-yl)ethylcarbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[1-(1-ethyl-5-methyl-4-pyrazolyl)ethylamino]-sulfanylidenemethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[1-(1-ethyl-5-methylpyrazol-4-yl)ethylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[1-(1-ethyl-5-methyl-pyrazol-4-yl)ethylthiocarbamoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H24N4O4S2 MolecularWeight: 424.53756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N4O4S2/c1-7-22-11(4)12(8-19-22)10(3)20-18(27)21-15-13(16(23)25-5)9(2)14(28-15)17(24)26-6/h8,10H,7H2,1-6H3,(H2,20,21,27)