N-(2-methylpropyl)-4-(1,4,5-triphenylimidazol-2-yl)sulfanyl-butanamide

Systemtic Name: N-(2-methylpropyl)-4-(1,4,5-triphenylimidazol-2-yl)sulfanyl-butanamide Openeye Name: N-isobutyl-4-(1,4,5-triphenylimidazol-2-yl)sulfanyl-butanamide CAS Name: N-(2-methylpropyl)-4-[(1,4,5-triphenyl-2-imidazolyl)thio]butanamide IUPAC Name: N-(2-methylpropyl)-4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutanamide Traditional Name: N-isobutyl-4-[(1,4,5-triphenylimidazol-2-yl)thio]butyramide Formula: C29H31N3OS MolecularWeight: 469.64094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)CCCSC1=NC(=C(N1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CNC(=O)CCCSC1=NC(=C(N1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H31N3OS/c1-22(2)21-30-26(33)19-12-20-34-29-31-27(23-13-6-3-7-14-23)28(24-15-8-4-9-16-24)32(29)25-17-10-5-11-18-25/h3-11,13-18,22H,12,19-21H2,1-2H3,(H,30,33)