4-tert-butyl-N-[4-(5-butylsulfanyl-4-methyl-1,2,4-triazol-3-yl)phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[4-(5-butylsulfanyl-4-methyl-1,2,4-triazol-3-yl)phenyl]benzamide Openeye Name: 4-tert-butyl-N-[4-(5-butylsulfanyl-4-methyl-1,2,4-triazol-3-yl)phenyl]benzamide CAS Name: 4-tert-butyl-N-[4-[5-(butylthio)-4-methyl-1,2,4-triazol-3-yl]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[4-(5-butylsulfanyl-4-methyl-1,2,4-triazol-3-yl)phenyl]benzamide Traditional Name: 4-tert-butyl-N-[4-[5-(butylthio)-4-methyl-1,2,4-triazol-3-yl]phenyl]benzamide Formula: C24H30N4OS MolecularWeight: 422.5862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(N1C)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCCCSC1=NN=C(N1C)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C24H30N4OS/c1-6-7-16-30-23-27-26-21(28(23)5)17-10-14-20(15-11-17)25-22(29)18-8-12-19(13-9-18)24(2,3)4/h8-15H,6-7,16H2,1-5H3,(H,25,29)