2-[2-[(2-chloranyl-4,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[2-[(2-chloranyl-4,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate Openeye Name: 2-[2-(2-chloro-4,6-dimethyl-anilino)-2-oxo-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate CAS Name: 2-[[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]thio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]sulfanyl-6-methylpyrimidin-4-olate Traditional Name: 2-[[2-(2-chloro-4,6-dimethyl-anilino)-2-keto-ethyl]thio]-6-methyl-pyrimidin-4-olate Formula: C15H15ClN3O2S- MolecularWeight: 336.8165

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)CSC2=NC(=CC(=N2)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)CSC2=NC(=CC(=N2)[O-])C)C

InChI

InChI=1S/C15H16ClN3O2S/c1-8-4-9(2)14(11(16)5-8)18-13(21)7-22-15-17-10(3)6-12(20)19-15/h4-6H,7H2,1-3H3,(H,18,21)(H,17,19,20)/p-1