6-azanyl-2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-phenyl-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-phenyl-1H-pyrimidin-4-one Openeye Name: 6-amino-5-phenyl-2-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-5-phenyl-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-phenyl-1H-pyrimidin-4-one Traditional Name: 6-amino-5-phenyl-2-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methylthio]-1H-pyrimidin-4-one Formula: C20H17N5O2S MolecularWeight: 391.44628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC(=O)C(=C(N3)N)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC(=O)C(=C(N3)N)C4=CC=CC=C4

InChI

InChI=1S/C20H17N5O2S/c1-12-7-9-14(10-8-12)18-22-15(27-25-18)11-28-20-23-17(21)16(19(26)24-20)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H3,21,23,24,26)