2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]pyridine-3-carboxylic acid Openeye Name: 2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]pyridine-3-carboxylic acid CAS Name: 2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methylthio]-3-pyridinecarboxylic acid IUPAC Name: 2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]pyridine-3-carboxylic acid Traditional Name: 2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methylthio]nicotinic acid Formula: C12H11N3O3S MolecularWeight: 277.29904

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NOC(=N2)CSC3=C(C=CC=N3)C(=O)O

Isomeric SMILES

C1CC1C2=NOC(=N2)CSC3=C(C=CC=N3)C(=O)O

InChI

InChI=1S/C12H11N3O3S/c16-12(17)8-2-1-5-13-11(8)19-6-9-14-10(15-18-9)7-3-4-7/h1-2,5,7H,3-4,6H2,(H,16,17)