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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=NN1)SCC(=O)NC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC(C)(C)C1=NC(=NN1)SCC(=O)NC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C16H23N5OS/c1-16(2,3)14-18-15(20-19-14)23-10-13(22)17-11-6-8-12(9-7-11)21(4)5/h6-9H,10H2,1-5H3,(H,17,22)(H,18,19,20)