4-(4-methyl-2-methylsulfanyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-8-yl)benzoic acid

Systemtic Name: 4-(4-methyl-2-methylsulfanyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-8-yl)benzoic acid Openeye Name: 4-(4-methyl-2-methylsulfanyl-7-oxo-pyrido[2,3-d]pyrimidin-8-yl)benzoic acid CAS Name: 4-[4-methyl-2-(methylthio)-7-oxo-8-pyrido[2,3-d]pyrimidinyl]benzoic acid IUPAC Name: 4-(4-methyl-2-methylsulfanyl-7-oxopyrido[2,3-d]pyrimidin-8-yl)benzoic acid Traditional Name: 4-[7-keto-4-methyl-2-(methylthio)pyrido[2,3-d]pyrimidin-8-yl]benzoic acid Formula: C16H13N3O3S MolecularWeight: 327.35772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=O)N(C2=NC(=N1)SC)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=C2C=CC(=O)N(C2=NC(=N1)SC)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H13N3O3S/c1-9-12-7-8-13(20)19(14(12)18-16(17-9)23-2)11-5-3-10(4-6-11)15(21)22/h3-8H,1-2H3,(H,21,22)