1-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]octan-4-one

Systemtic Name: 1-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]octan-4-one Openeye Name: 1-(1-methyltetrazol-5-yl)sulfanyloctan-4-one CAS Name: 1-[(1-methyl-5-tetrazolyl)thio]-4-octanone IUPAC Name: 1-(1-methyltetrazol-5-yl)sulfanyloctan-4-one Traditional Name: 1-[(1-methyltetrazol-5-yl)thio]octan-4-one Formula: C10H18N4OS MolecularWeight: 242.34112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)CCCSC1=NN=NN1C

Isomeric SMILES

CCCCC(=O)CCCSC1=NN=NN1C

InChI

InChI=1S/C10H18N4OS/c1-3-4-6-9(15)7-5-8-16-10-11-12-13-14(10)2/h3-8H2,1-2H3