1-[(4-oxidanylpiperidin-4-yl)-[6-[(phenylmethyl)amino]pyrimidin-4-yl]methyl]piperazin-2-one

Systemtic Name: 1-[(4-oxidanylpiperidin-4-yl)-[6-[(phenylmethyl)amino]pyrimidin-4-yl]methyl]piperazin-2-one Openeye Name: 1-[[6-(benzylamino)pyrimidin-4-yl]-(4-hydroxy-4-piperidyl)methyl]piperazin-2-one CAS Name: 1-[(4-hydroxy-4-piperidinyl)-[6-[(phenylmethyl)amino]-4-pyrimidinyl]methyl]-2-piperazinone IUPAC Name: 1-[[6-(benzylamino)pyrimidin-4-yl]-(4-hydroxypiperidin-4-yl)methyl]piperazin-2-one Traditional Name: 1-[[6-(benzylamino)pyrimidin-4-yl]-(4-hydroxy-4-piperidyl)methyl]piperazin-2-one Formula: C21H28N6O2 MolecularWeight: 396.48602

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1(C(C2=CC(=NC=N2)NCC3=CC=CC=C3)N4CCNCC4=O)O

Isomeric SMILES

C1CNCCC1(C(C2=CC(=NC=N2)NCC3=CC=CC=C3)N4CCNCC4=O)O

InChI

InChI=1S/C21H28N6O2/c28-19-14-23-10-11-27(19)20(21(29)6-8-22-9-7-21)17-12-18(26-15-25-17)24-13-16-4-2-1-3-5-16/h1-5,12,15,20,22-23,29H,6-11,13-14H2,(H,24,25,26)