N-[6-[[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]amino]-6-oxidanylidene-hexyl]benzamide

Systemtic Name: N-[6-[[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]amino]-6-oxidanylidene-hexyl]benzamide Openeye Name: N-[6-[[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]amino]-6-oxo-hexyl]benzamide CAS Name: N-[6-[[4-cyano-2-(4-methyl-2-quinolinyl)-3-pyrazolyl]amino]-6-oxohexyl]benzamide IUPAC Name: N-[6-[[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]amino]-6-oxohexyl]benzamide Traditional Name: N-[6-[[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]amino]-6-keto-hexyl]benzamide Formula: C27H26N6O2 MolecularWeight: 466.53434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)N3C(=C(C=N3)C#N)NC(=O)CCCCCNC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)N3C(=C(C=N3)C#N)NC(=O)CCCCCNC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H26N6O2/c1-19-16-24(31-23-13-8-7-12-22(19)23)33-26(21(17-28)18-30-33)32-25(34)14-6-3-9-15-29-27(35)20-10-4-2-5-11-20/h2,4-5,7-8,10-13,16,18H,3,6,9,14-15H2,1H3,(H,29,35)(H,32,34)