N-[2-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]-3,5,5-trimethyl-hexanamide

Systemtic Name: N-[2-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]-3,5,5-trimethyl-hexanamide Openeye Name: N-[2-(1-butyl-4,5-diphenyl-imidazol-2-yl)sulfanylethyl]-3,5,5-trimethyl-hexanamide CAS Name: N-[2-[(1-butyl-4,5-diphenyl-2-imidazolyl)thio]ethyl]-3,5,5-trimethylhexanamide IUPAC Name: N-[2-(1-butyl-4,5-diphenylimidazol-2-yl)sulfanylethyl]-3,5,5-trimethylhexanamide Traditional Name: N-[2-[(1-butyl-4,5-diphenyl-imidazol-2-yl)thio]ethyl]-3,5,5-trimethyl-hexanamide Formula: C30H41N3OS MolecularWeight: 491.73104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H41N3OS/c1-6-7-19-33-28(25-16-12-9-13-17-25)27(24-14-10-8-11-15-24)32-29(33)35-20-18-31-26(34)21-23(2)22-30(3,4)5/h8-17,23H,6-7,18-22H2,1-5H3,(H,31,34)