1-[3-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-4-methoxy-phenyl]ethanone

Systemtic Name: 1-[3-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-4-methoxy-phenyl]ethanone Openeye Name: 1-[3-[(1-cyclohexyltetrazol-5-yl)sulfanylmethyl]-4-methoxy-phenyl]ethanone CAS Name: 1-[3-[[(1-cyclohexyl-5-tetrazolyl)thio]methyl]-4-methoxyphenyl]ethanone IUPAC Name: 1-[3-[(1-cyclohexyltetrazol-5-yl)sulfanylmethyl]-4-methoxyphenyl]ethanone Traditional Name: 1-[3-[[(1-cyclohexyltetrazol-5-yl)thio]methyl]-4-methoxy-phenyl]ethanone Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NN=NN2C3CCCCC3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NN=NN2C3CCCCC3

InChI

InChI=1S/C17H22N4O2S/c1-12(22)13-8-9-16(23-2)14(10-13)11-24-17-18-19-20-21(17)15-6-4-3-5-7-15/h8-10,15H,3-7,11H2,1-2H3