ethyl 5-[[(Z)-2-cyano-3-methoxy-1-methylsulfanyl-3-oxidanylidene-prop-1-enyl]amino]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[(Z)-2-cyano-3-methoxy-1-methylsulfanyl-3-oxidanylidene-prop-1-enyl]amino]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[(Z)-2-cyano-3-methoxy-1-methylsulfanyl-3-oxo-prop-1-enyl]amino]-1H-pyrazole-4-carboxylate CAS Name: 5-[[(Z)-2-cyano-3-methoxy-1-(methylthio)-3-oxoprop-1-enyl]amino]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[(Z)-2-cyano-3-methoxy-1-methylsulfanyl-3-oxoprop-1-enyl]amino]-1H-pyrazole-4-carboxylate Traditional Name: 5-[[(Z)-2-cyano-3-keto-3-methoxy-1-(methylthio)prop-1-enyl]amino]-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C12H14N4O4S MolecularWeight: 310.32896

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)NC(=C(C#N)C(=O)OC)SC

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)N/C(=C(\C#N)/C(=O)OC)/SC

InChI

InChI=1S/C12H14N4O4S/c1-4-20-12(18)8-6-14-16-9(8)15-10(21-3)7(5-13)11(17)19-2/h6H,4H2,1-3H3,(H2,14,15,16)/b10-7-