N-[2-(dimethylamino)-2-phenyl-ethyl]-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[2-(dimethylamino)-2-phenyl-ethyl]-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[2-(dimethylamino)-2-phenyl-ethyl]-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[2-(dimethylamino)-2-phenylethyl]-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[2-(dimethylamino)-2-phenylethyl]-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[2-(dimethylamino)-2-phenyl-ethyl]-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C16H23N5OS MolecularWeight: 333.45172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)SCC(=O)NCC(C2=CC=CC=C2)N(C)C

Isomeric SMILES

CCC1=NC(=NN1)SCC(=O)NCC(C2=CC=CC=C2)N(C)C

InChI

InChI=1S/C16H23N5OS/c1-4-14-18-16(20-19-14)23-11-15(22)17-10-13(21(2)3)12-8-6-5-7-9-12/h5-9,13H,4,10-11H2,1-3H3,(H,17,22)(H,18,19,20)