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

Systemtic Name: 2-[[4-(4-hydroxyphenyl)carbonylphenyl]methylsulfanyl]-3-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[[4-(4-hydroxybenzoyl)phenyl]methylsulfanyl]-3-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[4-[(4-hydroxyphenyl)-oxomethyl]phenyl]methylthio]-3-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[[4-(4-hydroxybenzoyl)phenyl]methylsulfanyl]-3-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[4-(4-hydroxybenzoyl)benzyl]thio]-3-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C23H18N2O3S MolecularWeight: 402.46562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC=CN2C1=O)SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)O

Isomeric SMILES

CC1=C(N=C2C=CC=CN2C1=O)SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)O

InChI

InChI=1S/C23H18N2O3S/c1-15-22(24-20-4-2-3-13-25(20)23(15)28)29-14-16-5-7-17(8-6-16)21(27)18-9-11-19(26)12-10-18/h2-13,26H,14H2,1H3