(E)-2-cyano-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(1-prop-2-enyl-3,4-dihydro-2H-quinolin-6-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(1-prop-2-enyl-3,4-dihydro-2H-quinolin-6-yl)prop-2-enamide Openeye Name: (E)-3-(1-allyl-3,4-dihydro-2H-quinolin-6-yl)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)prop-2-enamide CAS Name: (E)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-(1-prop-2-enyl-3,4-dihydro-2H-quinolin-6-yl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(1-prop-2-enyl-3,4-dihydro-2H-quinolin-6-yl)prop-2-enamide Traditional Name: (E)-3-(1-allyl-3,4-dihydro-2H-quinolin-6-yl)-2-cyano-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acrylamide Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(=CC3=CC4=C(C=C3)N(CCC4)CC=C)C#N

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)/C(=C/C3=CC4=C(C=C3)N(CCC4)CC=C)/C#N

InChI

InChI=1S/C27H27N5O2/c1-4-14-31-15-8-9-21-16-20(12-13-24(21)31)17-22(18-28)26(33)29-25-19(2)30(3)32(27(25)34)23-10-6-5-7-11-23/h4-7,10-13,16-17H,1,8-9,14-15H2,2-3H3,(H,29,33)/b22-17+