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

Systemtic Name: 2-[[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]methyl]-5-(2-thienyl)-1H-1,2,4-triazole-3-thione CAS Name: 2-[[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[2-(1,3-benzothiazol-2-yl)pyrrolidino]methyl]-5-(2-thienyl)-1H-1,2,4-triazole-3-thione Formula: C18H17N5S3 MolecularWeight: 399.55608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CN2C(=S)N=C(N2)C3=CC=CS3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(N(C1)CN2C(=S)N=C(N2)C3=CC=CS3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C18H17N5S3/c24-18-20-16(15-8-4-10-25-15)21-23(18)11-22-9-3-6-13(22)17-19-12-5-1-2-7-14(12)26-17/h1-2,4-5,7-8,10,13H,3,6,9,11H2,(H,20,21,24)