5-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pentanoate

Systemtic Name: 5-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pentanoate Openeye Name: 5-(1-cyclopropyltetrazol-5-yl)sulfanylpentanoate CAS Name: 5-[(1-cyclopropyl-5-tetrazolyl)thio]pentanoate IUPAC Name: 5-(1-cyclopropyltetrazol-5-yl)sulfanylpentanoate Traditional Name: 5-[(1-cyclopropyltetrazol-5-yl)thio]valerate Formula: C9H13N4O2S- MolecularWeight: 241.29012

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=N2)SCCCCC(=O)[O-]

Isomeric SMILES

C1CC1N2C(=NN=N2)SCCCCC(=O)[O-]

InChI

InChI=1S/C9H14N4O2S/c14-8(15)3-1-2-6-16-9-10-11-12-13(9)7-4-5-7/h7H,1-6H2,(H,14,15)/p-1