2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonylsulfanyl]-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonylsulfanyl]-6-methyl-pyrimidin-4-olate Openeye Name: 2-[3-(2-chlorophenyl)-5-methyl-isoxazole-4-carbonyl]sulfanyl-6-methyl-pyrimidin-4-olate CAS Name: 2-[[[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]-oxomethyl]thio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]sulfanyl-6-methylpyrimidin-4-olate Traditional Name: 2-[[3-(2-chlorophenyl)-5-methyl-isoxazole-4-carbonyl]thio]-6-methyl-pyrimidin-4-olate Formula: C16H11ClN3O3S- MolecularWeight: 360.79484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(=O)C2=C(ON=C2C3=CC=CC=C3Cl)C)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SC(=O)C2=C(ON=C2C3=CC=CC=C3Cl)C)[O-]

InChI

InChI=1S/C16H12ClN3O3S/c1-8-7-12(21)19-16(18-8)24-15(22)13-9(2)23-20-14(13)10-5-3-4-6-11(10)17/h3-7H,1-2H3,(H,18,19,21)/p-1