N'-[(E)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)prop-2-enoyl]-2-pyridin-4-yl-quinoline-4-carbohydrazide

Systemtic Name: N'-[(E)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)prop-2-enoyl]-2-pyridin-4-yl-quinoline-4-carbohydrazide Openeye Name: N'-[(E)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)prop-2-enoyl]-2-(4-pyridyl)quinoline-4-carbohydrazide CAS Name: N'-[(E)-3-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-1-oxoprop-2-enyl]-2-pyridin-4-yl-4-quinolinecarbohydrazide IUPAC Name: N'-[(E)-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)prop-2-enoyl]-2-pyridin-4-ylquinoline-4-carbohydrazide Traditional Name: N'-[(E)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)acryloyl]-2-(4-pyridyl)cinchoninohydrazide Formula: C28H21ClN6O2 MolecularWeight: 508.95834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C28H21ClN6O2/c1-18-21(27(29)35(34-18)20-7-3-2-4-8-20)11-12-26(36)32-33-28(37)23-17-25(19-13-15-30-16-14-19)31-24-10-6-5-9-22(23)24/h2-17H,1H3,(H,32,36)(H,33,37)/b12-11+