4-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methylsulfanyl]-5-ethanoyl-6-methyl-1H-pyrimidin-2-one

Systemtic Name: 4-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methylsulfanyl]-5-ethanoyl-6-methyl-1H-pyrimidin-2-one Openeye Name: 5-acetyl-4-[[3-(4-chlorophenyl)isoxazol-5-yl]methylsulfanyl]-6-methyl-1H-pyrimidin-2-one CAS Name: 5-acetyl-4-[[3-(4-chlorophenyl)-5-isoxazolyl]methylthio]-6-methyl-1H-pyrimidin-2-one IUPAC Name: 5-acetyl-4-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methylsulfanyl]-6-methyl-1H-pyrimidin-2-one Traditional Name: 5-acetyl-4-[[3-(4-chlorophenyl)isoxazol-5-yl]methylthio]-6-methyl-1H-pyrimidin-2-one Formula: C17H14ClN3O3S MolecularWeight: 375.82936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC2=CC(=NO2)C3=CC=C(C=C3)Cl)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC2=CC(=NO2)C3=CC=C(C=C3)Cl)C(=O)C

InChI

InChI=1S/C17H14ClN3O3S/c1-9-15(10(2)22)16(20-17(23)19-9)25-8-13-7-14(21-24-13)11-3-5-12(18)6-4-11/h3-7H,8H2,1-2H3,(H,19,20,23)