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

Systemtic Name: 6-azanyl-2-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-1H-pyrimidin-4-one Formula: C13H10ClN5O2S MolecularWeight: 335.7688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NOC(=N2)CSC3=NC(=O)C=C(N3)N)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NOC(=N2)CSC3=NC(=O)C=C(N3)N)Cl

InChI

InChI=1S/C13H10ClN5O2S/c14-8-3-1-7(2-4-8)12-18-11(21-19-12)6-22-13-16-9(15)5-10(20)17-13/h1-5H,6H2,(H3,15,16,17,20)