N-[2-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]-3,4-bis(chloranyl)benzamide

Systemtic Name: N-[2-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]-3,4-bis(chloranyl)benzamide Openeye Name: N-[2-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]-3,4-dichloro-benzamide CAS Name: N-[2-[(1-butyl-4,5-diphenyl-2-imidazolyl)thio]ethyl]-3,4-dichlorobenzamide IUPAC Name: N-[2-(1-butyl-4,5-diphenylimidazol-2-yl)sulfanylethyl]-3,4-dichlorobenzamide Traditional Name: N-[2-[(1-butyl-4,5-diphenyl-imidazol-2-yl)thio]ethyl]-3,4-dichloro-benzamide Formula: C28H27Cl2N3OS MolecularWeight: 524.50448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCCNC(=O)C2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=C(N=C1SCCNC(=O)C2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H27Cl2N3OS/c1-2-3-17-33-26(21-12-8-5-9-13-21)25(20-10-6-4-7-11-20)32-28(33)35-18-16-31-27(34)22-14-15-23(29)24(30)19-22/h4-15,19H,2-3,16-18H2,1H3,(H,31,34)