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

Systemtic Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-4-propyl-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-4-propyl-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-4-propyl-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-4-propyl-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-4-propyl-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C20H22N6S2 MolecularWeight: 410.55888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN(C1=S)CN(C)CC2=NC3=CC=CC=C3S2)C4=CC=NC=C4

Isomeric SMILES

CCCN1C(=NN(C1=S)CN(C)CC2=NC3=CC=CC=C3S2)C4=CC=NC=C4

InChI

InChI=1S/C20H22N6S2/c1-3-12-25-19(15-8-10-21-11-9-15)23-26(20(25)27)14-24(2)13-18-22-16-6-4-5-7-17(16)28-18/h4-11H,3,12-14H2,1-2H3