1-[2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(1-cyclopropyltetrazol-5-yl)sulfanylacetyl]piperidine-4-carboxylic acid CAS Name: 1-[2-[(1-cyclopropyl-5-tetrazolyl)thio]-1-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(1-cyclopropyltetrazol-5-yl)sulfanylacetyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-[(1-cyclopropyltetrazol-5-yl)thio]acetyl]isonipecotic acid Formula: C12H17N5O3S MolecularWeight: 311.36008

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=N2)SCC(=O)N3CCC(CC3)C(=O)O

Isomeric SMILES

C1CC1N2C(=NN=N2)SCC(=O)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C12H17N5O3S/c18-10(16-5-3-8(4-6-16)11(19)20)7-21-12-13-14-15-17(12)9-1-2-9/h8-9H,1-7H2,(H,19,20)