3-[[cyclohexyl(methyl)amino]methyl]-5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole-2-thione

Systemtic Name: 3-[[cyclohexyl(methyl)amino]methyl]-5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole-2-thione Openeye Name: 3-[[cyclohexyl(methyl)amino]methyl]-5-[3-(1-piperidylsulfonyl)phenyl]-1,3,4-oxadiazole-2-thione CAS Name: 3-[[cyclohexyl(methyl)amino]methyl]-5-[3-(1-piperidinylsulfonyl)phenyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 3-[[cyclohexyl(methyl)amino]methyl]-5-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole-2-thione Traditional Name: 3-[[cyclohexyl(methyl)amino]methyl]-5-(3-piperidinosulfonylphenyl)-1,3,4-oxadiazole-2-thione Formula: C21H30N4O3S2 MolecularWeight: 450.6179

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Descriptors Computed from Structure

Canonical SMILES:

CN(CN1C(=S)OC(=N1)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)C4CCCCC4

Isomeric SMILES

CN(CN1C(=S)OC(=N1)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)C4CCCCC4

InChI

InChI=1S/C21H30N4O3S2/c1-23(18-10-4-2-5-11-18)16-25-21(29)28-20(22-25)17-9-8-12-19(15-17)30(26,27)24-13-6-3-7-14-24/h8-9,12,15,18H,2-7,10-11,13-14,16H2,1H3