2-methyl-1-[3-[2-methyl-5-(3-methylphenyl)pyrimidin-4-yl]piperidin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[3-[2-methyl-5-(3-methylphenyl)pyrimidin-4-yl]piperidin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[3-[2-methyl-5-(m-tolyl)pyrimidin-4-yl]-1-piperidyl]propan-1-one CAS Name: 2-methyl-1-[3-[2-methyl-5-(3-methylphenyl)-4-pyrimidinyl]-1-piperidinyl]-1-propanone IUPAC Name: 2-methyl-1-[3-[2-methyl-5-(3-methylphenyl)pyrimidin-4-yl]piperidin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[3-[2-methyl-5-(m-tolyl)pyrimidin-4-yl]piperidino]propan-1-one Formula: C21H27N3O MolecularWeight: 337.45858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O/c1-14(2)21(25)24-10-6-9-18(13-24)20-19(12-22-16(4)23-20)17-8-5-7-15(3)11-17/h5,7-8,11-12,14,18H,6,9-10,13H2,1-4H3