2-[(4-phenyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-pyrrol-1-yl-ethanamide

Systemtic Name: 2-[(4-phenyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-pyrrol-1-yl-ethanamide Openeye Name: 2-[(4-phenyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-pyrrol-1-yl-acetamide CAS Name: 2-[(4-phenyl-5-propyl-1,2,4-triazol-3-yl)thio]-N-(1-pyrrolyl)acetamide IUPAC Name: 2-[(4-phenyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-pyrrol-1-ylacetamide Traditional Name: 2-[(4-phenyl-5-propyl-1,2,4-triazol-3-yl)thio]-N-pyrrol-1-yl-acetamide Formula: C17H19N5OS MolecularWeight: 341.43066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C2=CC=CC=C2)SCC(=O)NN3C=CC=C3

Isomeric SMILES

CCCC1=NN=C(N1C2=CC=CC=C2)SCC(=O)NN3C=CC=C3

InChI

InChI=1S/C17H19N5OS/c1-2-8-15-18-19-17(22(15)14-9-4-3-5-10-14)24-13-16(23)20-21-11-6-7-12-21/h3-7,9-12H,2,8,13H2,1H3,(H,20,23)