(Z)-2-cyano-3-[3-(4-ethylsulfanylphenyl)-1-phenyl-pyrazol-4-yl]-N-prop-2-enyl-prop-2-enamide

Systemtic Name: (Z)-2-cyano-3-[3-(4-ethylsulfanylphenyl)-1-phenyl-pyrazol-4-yl]-N-prop-2-enyl-prop-2-enamide Openeye Name: (Z)-N-allyl-2-cyano-3-[3-(4-ethylsulfanylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide CAS Name: (Z)-2-cyano-3-[3-[4-(ethylthio)phenyl]-1-phenyl-4-pyrazolyl]-N-prop-2-enyl-2-propenamide IUPAC Name: (Z)-2-cyano-3-[3-(4-ethylsulfanylphenyl)-1-phenylpyrazol-4-yl]-N-prop-2-enylprop-2-enamide Traditional Name: (Z)-N-allyl-2-cyano-3-[3-[4-(ethylthio)phenyl]-1-phenyl-pyrazol-4-yl]acrylamide Formula: C24H22N4OS MolecularWeight: 414.52268

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC=C)C3=CC=CC=C3

Isomeric SMILES

CCSC1=CC=C(C=C1)C2=NN(C=C2/C=C(/C#N)\C(=O)NCC=C)C3=CC=CC=C3

InChI

InChI=1S/C24H22N4OS/c1-3-14-26-24(29)19(16-25)15-20-17-28(21-8-6-5-7-9-21)27-23(20)18-10-12-22(13-11-18)30-4-2/h3,5-13,15,17H,1,4,14H2,2H3,(H,26,29)/b19-15-