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

Systemtic Name: 2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-pyrimidin-6-one Openeye Name: 2-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-pyrimidin-6-one CAS Name: 2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-1H-pyrimidin-6-one IUPAC Name: 2-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-pyrimidin-6-one Traditional Name: 2-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methylthio]-1H-pyrimidin-6-one Formula: C14H12N4O2S MolecularWeight: 300.33568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N4O2S/c1-9-2-4-10(5-3-9)13-17-12(20-18-13)8-21-14-15-7-6-11(19)16-14/h2-7H,8H2,1H3,(H,15,16,19)