3-chloranyl-9-[(2S)-2-oxidanyl-2-phenyl-ethyl]-2-pyridin-4-yl-7,8-dihydro-6H-pyrimido[1,2-a]pyrimidin-4-one

Systemtic Name: 3-chloranyl-9-[(2S)-2-oxidanyl-2-phenyl-ethyl]-2-pyridin-4-yl-7,8-dihydro-6H-pyrimido[1,2-a]pyrimidin-4-one Openeye Name: 3-chloro-9-[(2S)-2-hydroxy-2-phenyl-ethyl]-2-(4-pyridyl)-7,8-dihydro-6H-pyrimido[1,2-a]pyrimidin-4-one CAS Name: 3-chloro-9-[(2S)-2-hydroxy-2-phenylethyl]-2-pyridin-4-yl-7,8-dihydro-6H-pyrimido[1,2-a]pyrimidin-4-one IUPAC Name: 3-chloro-9-[(2S)-2-hydroxy-2-phenylethyl]-2-pyridin-4-yl-7,8-dihydro-6H-pyrimido[1,2-a]pyrimidin-4-one Traditional Name: 3-chloro-9-[(2S)-2-hydroxy-2-phenyl-ethyl]-2-(4-pyridyl)-7,8-dihydro-6H-pyrimido[1,2-a]pyrimidin-4-one Formula: C20H19ClN4O2 MolecularWeight: 382.84346

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=NC(=C(C(=O)N2C1)Cl)C3=CC=NC=C3)CC(C4=CC=CC=C4)O

Isomeric SMILES

C1CN(C2=NC(=C(C(=O)N2C1)Cl)C3=CC=NC=C3)C[C@H](C4=CC=CC=C4)O

InChI

InChI=1S/C20H19ClN4O2/c21-17-18(15-7-9-22-10-8-15)23-20-24(11-4-12-25(20)19(17)27)13-16(26)14-5-2-1-3-6-14/h1-3,5-10,16,26H,4,11-13H2/t16-/m1/s1