2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylphenyl)-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylphenyl)-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(m-tolyl)acetamide CAS Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(3-methylphenyl)-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylphenyl)acetamide Traditional Name: N-benzyl-2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(m-tolyl)acetamide Formula: C22H26N4OS MolecularWeight: 394.53304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC2=CC=CC=C2)C(=O)CSC3=NNC(=N3)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CC2=CC=CC=C2)C(=O)CSC3=NNC(=N3)C(C)(C)C

InChI

InChI=1S/C22H26N4OS/c1-16-9-8-12-18(13-16)26(14-17-10-6-5-7-11-17)19(27)15-28-21-23-20(24-25-21)22(2,3)4/h5-13H,14-15H2,1-4H3,(H,23,24,25)