2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pyridine-4-carboxylate

Systemtic Name: 2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pyridine-4-carboxylate Openeye Name: 2-(1-cyclopentyltetrazol-5-yl)sulfanylpyridine-4-carboxylate CAS Name: 2-[(1-cyclopentyl-5-tetrazolyl)thio]-4-pyridinecarboxylate IUPAC Name: 2-(1-cyclopentyltetrazol-5-yl)sulfanylpyridine-4-carboxylate Traditional Name: 2-[(1-cyclopentyltetrazol-5-yl)thio]isonicotinate Formula: C12H12N5O2S- MolecularWeight: 290.32098

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=NN=N2)SC3=NC=CC(=C3)C(=O)[O-]

Isomeric SMILES

C1CCC(C1)N2C(=NN=N2)SC3=NC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C12H13N5O2S/c18-11(19)8-5-6-13-10(7-8)20-12-14-15-16-17(12)9-3-1-2-4-9/h5-7,9H,1-4H2,(H,18,19)/p-1