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

Systemtic Name: 1-[2-azanyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperidin-3-one Openeye Name: 1-[2-amino-5-(p-tolylmethyl)pyrimidin-4-yl]piperidin-3-one CAS Name: 1-[2-amino-5-[(4-methylphenyl)methyl]-4-pyrimidinyl]-3-piperidinone IUPAC Name: 1-[2-amino-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperidin-3-one Traditional Name: 1-[2-amino-5-(4-methylbenzyl)pyrimidin-4-yl]-3-piperidone Formula: C17H20N4O MolecularWeight: 296.3669

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=CN=C(N=C2N3CCCC(=O)C3)N

Isomeric SMILES

CC1=CC=C(C=C1)CC2=CN=C(N=C2N3CCCC(=O)C3)N

InChI

InChI=1S/C17H20N4O/c1-12-4-6-13(7-5-12)9-14-10-19-17(18)20-16(14)21-8-2-3-15(22)11-21/h4-7,10H,2-3,8-9,11H2,1H3,(H2,18,19,20)