1-(4-cyclohexylphenyl)-2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-cyclohexylphenyl)-2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-cyclohexylphenyl)ethanone CAS Name: 1-(4-cyclohexylphenyl)-2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-cyclohexylphenyl)ethanone Traditional Name: 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)thio]-1-(4-cyclohexylphenyl)ethanone Formula: C24H27N3OS MolecularWeight: 405.55568

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C3CCCCC3)CC4=CC=CC=C4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C3CCCCC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H27N3OS/c1-27-23(16-18-8-4-2-5-9-18)25-26-24(27)29-17-22(28)21-14-12-20(13-15-21)19-10-6-3-7-11-19/h2,4-5,8-9,12-15,19H,3,6-7,10-11,16-17H2,1H3