2-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[[3-(4-methoxyphenyl)isoxazol-5-yl]methylsulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[[3-(4-methoxyphenyl)-5-isoxazolyl]methylthio]methyl]-7-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfanylmethyl]-7-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[[3-(4-methoxyphenyl)isoxazol-5-yl]methylthio]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CSCC3=CC(=NO3)C4=CC=C(C=C4)OC)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CSCC3=CC(=NO3)C4=CC=C(C=C4)OC)C=C1

InChI

InChI=1S/C21H19N3O3S/c1-14-3-8-20-22-16(9-21(25)24(20)11-14)12-28-13-18-10-19(23-27-18)15-4-6-17(26-2)7-5-15/h3-11H,12-13H2,1-2H3