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

Systemtic Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-5-(2-thienyl)-1H-1,2,4-triazole-3-thione CAS Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-5-(2-thienyl)-1H-1,2,4-triazole-3-thione Formula: C16H15N5S3 MolecularWeight: 373.5188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)CN3C(=S)N=C(N3)C4=CC=CS4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)CN3C(=S)N=C(N3)C4=CC=CS4

InChI

InChI=1S/C16H15N5S3/c1-20(9-14-17-11-5-2-3-6-12(11)24-14)10-21-16(22)18-15(19-21)13-7-4-8-23-13/h2-8H,9-10H2,1H3,(H,18,19,22)