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

Systemtic Name: 1-cyclohexyl-4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butan-1-one Openeye Name: 1-cyclohexyl-4-(1-methyltetrazol-5-yl)sulfanyl-butan-1-one CAS Name: 1-cyclohexyl-4-[(1-methyl-5-tetrazolyl)thio]-1-butanone IUPAC Name: 1-cyclohexyl-4-(1-methyltetrazol-5-yl)sulfanylbutan-1-one Traditional Name: 1-cyclohexyl-4-[(1-methyltetrazol-5-yl)thio]butan-1-one Formula: C12H20N4OS MolecularWeight: 268.3784

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCCCC(=O)C2CCCCC2

Isomeric SMILES

CN1C(=NN=N1)SCCCC(=O)C2CCCCC2

InChI

InChI=1S/C12H20N4OS/c1-16-12(13-14-15-16)18-9-5-8-11(17)10-6-3-2-4-7-10/h10H,2-9H2,1H3