3,3-dimethyl-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]butanamide

Systemtic Name: 3,3-dimethyl-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]butanamide Openeye Name: 3,3-dimethyl-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]butanamide CAS Name: 3,3-dimethyl-N-[4-[(1,4,5-triphenyl-2-imidazolyl)thio]butyl]butanamide IUPAC Name: 3,3-dimethyl-N-[4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutyl]butanamide Traditional Name: 3,3-dimethyl-N-[4-[(1,4,5-triphenylimidazol-2-yl)thio]butyl]butyramide Formula: C31H35N3OS MolecularWeight: 497.6941

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NCCCCSC1=NC(=C(N1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)CC(=O)NCCCCSC1=NC(=C(N1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H35N3OS/c1-31(2,3)23-27(35)32-21-13-14-22-36-30-33-28(24-15-7-4-8-16-24)29(25-17-9-5-10-18-25)34(30)26-19-11-6-12-20-26/h4-12,15-20H,13-14,21-23H2,1-3H3,(H,32,35)