2-[3-(5-methyl-2-pyridin-3-yl-pyrimidin-4-yl)piperidin-1-yl]carbonylchromen-4-one

Systemtic Name: 2-[3-(5-methyl-2-pyridin-3-yl-pyrimidin-4-yl)piperidin-1-yl]carbonylchromen-4-one Openeye Name: 2-[3-[5-methyl-2-(3-pyridyl)pyrimidin-4-yl]piperidine-1-carbonyl]chromen-4-one CAS Name: 2-[[3-[5-methyl-2-(3-pyridinyl)-4-pyrimidinyl]-1-piperidinyl]-oxomethyl]-1-benzopyran-4-one IUPAC Name: 2-[3-(5-methyl-2-pyridin-3-ylpyrimidin-4-yl)piperidine-1-carbonyl]chromen-4-one Traditional Name: 2-[3-[5-methyl-2-(3-pyridyl)pyrimidin-4-yl]piperidine-1-carbonyl]chromone Formula: C25H22N4O3 MolecularWeight: 426.46718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2CCCN(C2)C(=O)C3=CC(=O)C4=CC=CC=C4O3)C5=CN=CC=C5

Isomeric SMILES

CC1=CN=C(N=C1C2CCCN(C2)C(=O)C3=CC(=O)C4=CC=CC=C4O3)C5=CN=CC=C5

InChI

InChI=1S/C25H22N4O3/c1-16-13-27-24(17-6-4-10-26-14-17)28-23(16)18-7-5-11-29(15-18)25(31)22-12-20(30)19-8-2-3-9-21(19)32-22/h2-4,6,8-10,12-14,18H,5,7,11,15H2,1H3