(5R)-1-[(3-methoxyphenyl)methyl]-5-[(4-pyrimidin-2-yl-1,4-diazepan-1-yl)carbonyl]piperidin-2-one

Systemtic Name: (5R)-1-[(3-methoxyphenyl)methyl]-5-[(4-pyrimidin-2-yl-1,4-diazepan-1-yl)carbonyl]piperidin-2-one Openeye Name: (5R)-1-[(3-methoxyphenyl)methyl]-5-(4-pyrimidin-2-yl-1,4-diazepane-1-carbonyl)piperidin-2-one CAS Name: (5R)-1-[(3-methoxyphenyl)methyl]-5-[oxo-[4-(2-pyrimidinyl)-1,4-diazepan-1-yl]methyl]-2-piperidinone IUPAC Name: (5R)-1-[(3-methoxyphenyl)methyl]-5-(4-pyrimidin-2-yl-1,4-diazepane-1-carbonyl)piperidin-2-one Traditional Name: (5R)-1-m-anisyl-5-[4-(2-pyrimidyl)-1,4-diazepane-1-carbonyl]-2-piperidone Formula: C23H29N5O3 MolecularWeight: 423.50806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CC(CCC2=O)C(=O)N3CCCN(CC3)C4=NC=CC=N4

Isomeric SMILES

COC1=CC=CC(=C1)CN2C[C@@H](CCC2=O)C(=O)N3CCCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C23H29N5O3/c1-31-20-6-2-5-18(15-20)16-28-17-19(7-8-21(28)29)22(30)26-11-4-12-27(14-13-26)23-24-9-3-10-25-23/h2-3,5-6,9-10,15,19H,4,7-8,11-14,16-17H2,1H3/t19-/m1/s1