(E)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-N-quinolin-5-yl-prop-2-enamide hydrochloride

Systemtic Name: (E)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-N-quinolin-5-yl-prop-2-enamide hydrochloride Openeye Name: (E)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-N-(5-quinolyl)prop-2-enamide hydrochloride CAS Name: (E)-3-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-2-cyano-N-(5-quinolinyl)-2-propenamide hydrochloride IUPAC Name: (E)-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-2-cyano-N-quinolin-5-ylprop-2-enamide hydrochloride Traditional Name: (E)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-2-cyano-N-(5-quinolyl)acrylamide hydrochloride Formula: C23H17Cl2N5O MolecularWeight: 450.31998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=C(C#N)C(=O)NC2=CC=CC3=C2C=CC=N3)Cl)C4=CC=CC=C4.Cl

Isomeric SMILES

CC1=NN(C(=C1/C=C(\C#N)/C(=O)NC2=CC=CC3=C2C=CC=N3)Cl)C4=CC=CC=C4.Cl

InChI

InChI=1S/C23H16ClN5O.ClH/c1-15-19(22(24)29(28-15)17-7-3-2-4-8-17)13-16(14-25)23(30)27-21-11-5-10-20-18(21)9-6-12-26-20;/h2-13H,1H3,(H,27,30);1H/b16-13+;