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

Systemtic Name: 2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]pyridine-3-carboxylic acid Openeye Name: 2-[(1-cyclopropyltetrazol-5-yl)methylsulfanyl]pyridine-3-carboxylic acid CAS Name: 2-[(1-cyclopropyl-5-tetrazolyl)methylthio]-3-pyridinecarboxylic acid IUPAC Name: 2-[(1-cyclopropyltetrazol-5-yl)methylsulfanyl]pyridine-3-carboxylic acid Traditional Name: 2-[(1-cyclopropyltetrazol-5-yl)methylthio]nicotinic acid Formula: C11H11N5O2S MolecularWeight: 277.30234

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=N2)CSC3=C(C=CC=N3)C(=O)O

Isomeric SMILES

C1CC1N2C(=NN=N2)CSC3=C(C=CC=N3)C(=O)O

InChI

InChI=1S/C11H11N5O2S/c17-11(18)8-2-1-5-12-10(8)19-6-9-13-14-15-16(9)7-3-4-7/h1-2,5,7H,3-4,6H2,(H,17,18)