5-(1-methyl-1,2,3,4-tetrazol-5-yl)pentanethioic S-acid

Systemtic Name: 5-(1-methyl-1,2,3,4-tetrazol-5-yl)pentanethioic S-acid Openeye Name: 5-(1-methyltetrazol-5-yl)pentanethioic S-acid CAS Name: 5-(1-methyl-5-tetrazolyl)pentanethioic S-acid IUPAC Name: 5-(1-methyltetrazol-5-yl)pentanethioic S-acid Traditional Name: 5-(1-methyltetrazol-5-yl)thiovaleric acid Formula: C7H12N4OS MolecularWeight: 200.26138

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)CCCCC(=O)S

Isomeric SMILES

CN1C(=NN=N1)CCCCC(=O)S

InChI

InChI=1S/C7H12N4OS/c1-11-6(8-9-10-11)4-2-3-5-7(12)13/h2-5H2,1H3,(H,12,13)