1H-indol-2-yl-[3-[2-methyl-5-(3-methylphenyl)pyrimidin-4-yl]piperidin-1-yl]methanone

Systemtic Name: 1H-indol-2-yl-[3-[2-methyl-5-(3-methylphenyl)pyrimidin-4-yl]piperidin-1-yl]methanone Openeye Name: 1H-indol-2-yl-[3-[2-methyl-5-(m-tolyl)pyrimidin-4-yl]-1-piperidyl]methanone CAS Name: 1H-indol-2-yl-[3-[2-methyl-5-(3-methylphenyl)-4-pyrimidinyl]-1-piperidinyl]methanone IUPAC Name: 1H-indol-2-yl-[3-[2-methyl-5-(3-methylphenyl)pyrimidin-4-yl]piperidin-1-yl]methanone Traditional Name: 1H-indol-2-yl-[3-[2-methyl-5-(m-tolyl)pyrimidin-4-yl]piperidino]methanone Formula: C26H26N4O MolecularWeight: 410.51084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CN=C(N=C2C3CCCN(C3)C(=O)C4=CC5=CC=CC=C5N4)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=CN=C(N=C2C3CCCN(C3)C(=O)C4=CC5=CC=CC=C5N4)C

InChI

InChI=1S/C26H26N4O/c1-17-7-5-9-19(13-17)22-15-27-18(2)28-25(22)21-10-6-12-30(16-21)26(31)24-14-20-8-3-4-11-23(20)29-24/h3-5,7-9,11,13-15,21,29H,6,10,12,16H2,1-2H3