[1-[5-(3-methylphenyl)pyrimidin-2-yl]piperidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone

Systemtic Name: [1-[5-(3-methylphenyl)pyrimidin-2-yl]piperidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone Openeye Name: [1-[5-(m-tolyl)pyrimidin-2-yl]-4-piperidyl]-[4-(1-piperidyl)-1-piperidyl]methanone CAS Name: [1-[5-(3-methylphenyl)-2-pyrimidinyl]-4-piperidinyl]-[4-(1-piperidinyl)-1-piperidinyl]methanone IUPAC Name: [1-[5-(3-methylphenyl)pyrimidin-2-yl]piperidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone Traditional Name: [1-[5-(m-tolyl)pyrimidin-2-yl]-4-piperidyl]-(4-piperidinopiperidino)methanone Formula: C27H37N5O MolecularWeight: 447.61558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CN=C(N=C2)N3CCC(CC3)C(=O)N4CCC(CC4)N5CCCCC5

Isomeric SMILES

CC1=CC=CC(=C1)C2=CN=C(N=C2)N3CCC(CC3)C(=O)N4CCC(CC4)N5CCCCC5

InChI

InChI=1S/C27H37N5O/c1-21-6-5-7-23(18-21)24-19-28-27(29-20-24)32-14-8-22(9-15-32)26(33)31-16-10-25(11-17-31)30-12-3-2-4-13-30/h5-7,18-20,22,25H,2-4,8-17H2,1H3