3-[7-cyano-1-[5-(2,6-dimethylpiperidin-2-yl)pentyl]-2-oxidanylidene-quinolin-3-yl]benzenecarboximidamide

Systemtic Name: 3-[7-cyano-1-[5-(2,6-dimethylpiperidin-2-yl)pentyl]-2-oxidanylidene-quinolin-3-yl]benzenecarboximidamide Openeye Name: 3-[7-cyano-1-[5-(2,6-dimethyl-2-piperidyl)pentyl]-2-oxo-3-quinolyl]benzamidine CAS Name: 3-[7-cyano-1-[5-(2,6-dimethyl-2-piperidinyl)pentyl]-2-oxo-3-quinolinyl]benzenecarboximidamide IUPAC Name: 3-[7-cyano-1-[5-(2,6-dimethylpiperidin-2-yl)pentyl]-2-oxoquinolin-3-yl]benzenecarboximidamide Traditional Name: 3-[7-cyano-1-[5-(2,6-dimethyl-2-piperidyl)pentyl]-2-keto-3-quinolyl]benzamidine Formula: C29H35N5O MolecularWeight: 469.6211

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1)(C)CCCCCN2C3=C(C=CC(=C3)C#N)C=C(C2=O)C4=CC(=CC=C4)C(=N)N

Isomeric SMILES

CC1CCCC(N1)(C)CCCCCN2C3=C(C=CC(=C3)C#N)C=C(C2=O)C4=CC(=CC=C4)C(=N)N

InChI

InChI=1S/C29H35N5O/c1-20-8-7-14-29(2,33-20)13-4-3-5-15-34-26-16-21(19-30)11-12-23(26)18-25(28(34)35)22-9-6-10-24(17-22)27(31)32/h6,9-12,16-18,20,33H,3-5,7-8,13-15H2,1-2H3,(H3,31,32)