2-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-pentan-3-yl-ethanamide

Systemtic Name: 2-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-pentan-3-yl-ethanamide Openeye Name: 2-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-ethylpropyl)acetamide CAS Name: 2-[[5-[(1,3-benzothiazol-2-ylthio)methyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-N-pentan-3-ylacetamide IUPAC Name: 2-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-pentan-3-ylacetamide Traditional Name: 2-[[5-[(1,3-benzothiazol-2-ylthio)methyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(1-ethylpropyl)acetamide Formula: C19H25N5OS3 MolecularWeight: 435.6297

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CSC1=NN=C(N1CC)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCC(CC)NC(=O)CSC1=NN=C(N1CC)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H25N5OS3/c1-4-13(5-2)20-17(25)12-26-18-23-22-16(24(18)6-3)11-27-19-21-14-9-7-8-10-15(14)28-19/h7-10,13H,4-6,11-12H2,1-3H3,(H,20,25)