2-[(6E)-2-azanyl-3-cyano-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]-N-(2-piperidin-1-ylethyl)benzamide

Systemtic Name: 2-[(6E)-2-azanyl-3-cyano-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]-N-(2-piperidin-1-ylethyl)benzamide Openeye Name: 2-[(6E)-2-amino-3-cyano-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]-N-[2-(1-piperidyl)ethyl]benzamide CAS Name: 2-[(6E)-2-amino-3-cyano-6-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-pyridin-4-yl]-N-[2-(1-piperidinyl)ethyl]benzamide IUPAC Name: 2-[(6E)-2-amino-3-cyano-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]-N-(2-piperidin-1-ylethyl)benzamide Traditional Name: 2-[(6E)-2-amino-3-cyano-6-(6-ketocyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]-N-(2-piperidinoethyl)benzamide Formula: C26H27N5O2 MolecularWeight: 441.52488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC(=O)C2=CC=CC=C2C3=CC(=C4C=CC=CC4=O)NC(=C3C#N)N

Isomeric SMILES

C1CCN(CC1)CCNC(=O)C2=CC=CC=C2C3=C/C(=C\4/C=CC=CC4=O)/NC(=C3C#N)N

InChI

InChI=1S/C26H27N5O2/c27-17-22-21(16-23(30-25(22)28)20-10-4-5-11-24(20)32)18-8-2-3-9-19(18)26(33)29-12-15-31-13-6-1-7-14-31/h2-5,8-11,16,30H,1,6-7,12-15,28H2,(H,29,33)/b23-20+