N-(1,3-benzothiazol-2-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C17H13N5OS2 MolecularWeight: 367.44802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NN=C2SCC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)N2C=NN=C2SCC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H13N5OS2/c23-15(20-16-19-13-8-4-5-9-14(13)25-16)10-24-17-21-18-11-22(17)12-6-2-1-3-7-12/h1-9,11H,10H2,(H,19,20,23)