1-[[4-(4-hydroxyphenyl)carbonylphenyl]methylsulfanyl]-3-methyl-6H-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 1-[[4-(4-hydroxyphenyl)carbonylphenyl]methylsulfanyl]-3-methyl-6H-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 1-[[4-(4-hydroxybenzoyl)phenyl]methylsulfanyl]-3-methyl-6H-pyrido[1,2-a]pyrimidin-4-one CAS Name: 1-[[4-[(4-hydroxyphenyl)-oxomethyl]phenyl]methylthio]-3-methyl-6H-pyrido[1,2-a]pyrimidin-4-one IUPAC Name: 1-[[4-(4-hydroxybenzoyl)phenyl]methylsulfanyl]-3-methyl-6H-pyrido[1,2-a]pyrimidin-4-one Traditional Name: 1-[[4-(4-hydroxybenzoyl)benzyl]thio]-3-methyl-6H-pyrido[1,2-a]pyrimidin-4-one Formula: C23H20N2O3S MolecularWeight: 404.4815

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=CC=CCN2C1=O)SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)O

Isomeric SMILES

CC1=CN(C2=CC=CCN2C1=O)SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)O

InChI

InChI=1S/C23H20N2O3S/c1-16-14-25(21-4-2-3-13-24(21)23(16)28)29-15-17-5-7-18(8-6-17)22(27)19-9-11-20(26)12-10-19/h2-12,14,26H,13,15H2,1H3