ethyl (Z)-2-cyano-3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-3-methylsulfanyl-prop-2-enoate

Systemtic Name: ethyl (Z)-2-cyano-3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-3-methylsulfanyl-prop-2-enoate Openeye Name: ethyl (Z)-2-cyano-3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-3-methylsulfanyl-prop-2-enoate CAS Name: (Z)-2-cyano-3-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-3-(methylthio)-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-cyano-3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-3-methylsulfanylprop-2-enoate Traditional Name: (Z)-2-cyano-3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]-3-(methylthio)acrylic acid ethyl ester Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(NC1=C(N(N(C1=O)C2=CC=CC=C2)C)C)SC)C#N

Isomeric SMILES

CCOC(=O)/C(=C(/NC1=C(N(N(C1=O)C2=CC=CC=C2)C)C)\SC)/C#N

InChI

InChI=1S/C18H20N4O3S/c1-5-25-18(24)14(11-19)16(26-4)20-15-12(2)21(3)22(17(15)23)13-9-7-6-8-10-13/h6-10,20H,5H2,1-4H3/b16-14-