4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]benzoic acid

Systemtic Name: 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]benzoic acid Openeye Name: 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]benzoic acid CAS Name: 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylthio]benzoic acid IUPAC Name: 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]benzoic acid Traditional Name: 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylthio]benzoic acid Formula: C11H10N2O3S MolecularWeight: 250.2737

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NO1)CSC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=NC(=NO1)CSC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C11H10N2O3S/c1-7-12-10(13-16-7)6-17-9-4-2-8(3-5-9)11(14)15/h2-5H,6H2,1H3,(H,14,15)