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

Systemtic Name: 5-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pentan-2-one Openeye Name: 5-(1-methyltetrazol-5-yl)sulfanylpentan-2-one CAS Name: 5-[(1-methyl-5-tetrazolyl)thio]-2-pentanone IUPAC Name: 5-(1-methyltetrazol-5-yl)sulfanylpentan-2-one Traditional Name: 5-[(1-methyltetrazol-5-yl)thio]pentan-2-one Formula: C7H12N4OS MolecularWeight: 200.26138

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCSC1=NN=NN1C

Isomeric SMILES

CC(=O)CCCSC1=NN=NN1C

InChI

InChI=1S/C7H12N4OS/c1-6(12)4-3-5-13-7-8-9-10-11(7)2/h3-5H2,1-2H3