4-[1-(2-bromophenyl)sulfanylcyclopropyl]-8-cyclopropylidene-5-oxidanylidene-N-(phenylmethyl)octanamide

Systemtic Name: 4-[1-(2-bromophenyl)sulfanylcyclopropyl]-8-cyclopropylidene-5-oxidanylidene-N-(phenylmethyl)octanamide Openeye Name: N-benzyl-4-[1-(2-bromophenyl)sulfanylcyclopropyl]-8-cyclopropylidene-5-oxo-octanamide CAS Name: 4-[1-[(2-bromophenyl)thio]cyclopropyl]-8-cyclopropylidene-5-oxo-N-(phenylmethyl)octanamide IUPAC Name: N-benzyl-4-[1-(2-bromophenyl)sulfanylcyclopropyl]-8-cyclopropylidene-5-oxooctanamide Traditional Name: N-benzyl-4-[1-[(2-bromophenyl)thio]cyclopropyl]-8-cyclopropylidene-5-keto-caprylamide Formula: C27H30BrNO2S MolecularWeight: 512.5016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1=CCCC(=O)C(CCC(=O)NCC2=CC=CC=C2)C3(CC3)SC4=CC=CC=C4Br

Isomeric SMILES

C1CC1=CCCC(=O)C(CCC(=O)NCC2=CC=CC=C2)C3(CC3)SC4=CC=CC=C4Br

InChI

InChI=1S/C27H30BrNO2S/c28-23-10-4-5-12-25(23)32-27(17-18-27)22(24(30)11-6-9-20-13-14-20)15-16-26(31)29-19-21-7-2-1-3-8-21/h1-5,7-10,12,22H,6,11,13-19H2,(H,29,31)