S-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl) 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbothioate

Systemtic Name: S-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl) 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbothioate Openeye Name: S-(6-methyl-4-oxo-1H-pyrimidin-2-yl) 3-(2-chlorophenyl)-5-methyl-isoxazole-4-carbothioate CAS Name: 3-(2-chlorophenyl)-5-methyl-4-isoxazolecarbothioic acid S-(6-methyl-4-oxo-1H-pyrimidin-2-yl) ester IUPAC Name: S-(6-methyl-4-oxo-1H-pyrimidin-2-yl) 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbothioate Traditional Name: 3-(2-chlorophenyl)-5-methyl-isoxazole-4-carbothioic acid S-(4-keto-6-methyl-1H-pyrimidin-2-yl) ester Formula: C16H12ClN3O3S MolecularWeight: 361.80278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SC(=O)C2=C(ON=C2C3=CC=CC=C3Cl)C

Isomeric SMILES

CC1=CC(=O)N=C(N1)SC(=O)C2=C(ON=C2C3=CC=CC=C3Cl)C

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)