1-butyl-2-(hydroxymethyl)-5-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]piperidine-3,4-diol

Systemtic Name: 1-butyl-2-(hydroxymethyl)-5-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]piperidine-3,4-diol Openeye Name: 1-butyl-2-(hydroxymethyl)-5-(1-methyltetrazol-5-yl)sulfanyl-piperidine-3,4-diol CAS Name: 1-butyl-2-(hydroxymethyl)-5-[(1-methyl-5-tetrazolyl)thio]piperidine-3,4-diol IUPAC Name: 1-butyl-2-(hydroxymethyl)-5-(1-methyltetrazol-5-yl)sulfanylpiperidine-3,4-diol Traditional Name: 1-butyl-2-methylol-5-[(1-methyltetrazol-5-yl)thio]piperidine-3,4-diol Formula: C12H23N5O3S MolecularWeight: 317.40772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(C(C(C1CO)O)O)SC2=NN=NN2C

Isomeric SMILES

CCCCN1CC(C(C(C1CO)O)O)SC2=NN=NN2C

InChI

InChI=1S/C12H23N5O3S/c1-3-4-5-17-6-9(11(20)10(19)8(17)7-18)21-12-13-14-15-16(12)2/h8-11,18-20H,3-7H2,1-2H3