5-chloranyl-2-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)oxy]benzoic acid

Systemtic Name: 5-chloranyl-2-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)oxy]benzoic acid Openeye Name: 5-chloro-2-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)oxy]benzoic acid CAS Name: 5-chloro-2-[[2-(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]oxy]benzoic acid IUPAC Name: 5-chloro-2-[(2-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)oxy]benzoic acid Traditional Name: 5-chloro-2-[[2-(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]oxy]benzoic acid Formula: C15H13ClN2O3S MolecularWeight: 336.79332

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(CCC2)C(=N1)OC3=C(C=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CSC1=NC2=C(CCC2)C(=N1)OC3=C(C=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C15H13ClN2O3S/c1-22-15-17-11-4-2-3-9(11)13(18-15)21-12-6-5-8(16)7-10(12)14(19)20/h5-7H,2-4H2,1H3,(H,19,20)