2-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[4-(1,3-benzothiazol-2-yl)-1-piperidyl]methyl]-5-(2-thienyl)-1H-1,2,4-triazole-3-thione CAS Name: 2-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[4-(1,3-benzothiazol-2-yl)piperidino]methyl]-5-(2-thienyl)-1H-1,2,4-triazole-3-thione Formula: C19H19N5S3 MolecularWeight: 413.58266

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)CN4C(=S)N=C(N4)C5=CC=CS5

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)CN4C(=S)N=C(N4)C5=CC=CS5

InChI

InChI=1S/C19H19N5S3/c25-19-21-17(16-6-3-11-26-16)22-24(19)12-23-9-7-13(8-10-23)18-20-14-4-1-2-5-15(14)27-18/h1-6,11,13H,7-10,12H2,(H,21,22,25)