2-[[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-4-pentyl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-4-pentyl-1,2,4-triazole-3-thione Openeye Name: 2-[[(2R)-2-(1,3-benzothiazol-2-yl)-1-piperidyl]methyl]-4-pentyl-1,2,4-triazole-3-thione CAS Name: 2-[[(2R)-2-(1,3-benzothiazol-2-yl)-1-piperidinyl]methyl]-4-pentyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-4-pentyl-1,2,4-triazole-3-thione Traditional Name: 4-amyl-2-[[(2R)-2-(1,3-benzothiazol-2-yl)piperidino]methyl]-1,2,4-triazole-3-thione Formula: C20H27N5S2 MolecularWeight: 401.59188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=NN(C1=S)CN2CCCCC2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCCCN1C=NN(C1=S)CN2CCCC[C@@H]2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H27N5S2/c1-2-3-7-12-23-14-21-25(20(23)26)15-24-13-8-6-10-17(24)19-22-16-9-4-5-11-18(16)27-19/h4-5,9,11,14,17H,2-3,6-8,10,12-13,15H2,1H3/t17-/m1/s1