2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylbutyl)benzamide

Systemtic Name: 2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylbutyl)benzamide Openeye Name: 2-[2-(cyclooctylamino)-2-oxo-ethyl]sulfanyl-N-isopentyl-benzamide CAS Name: 2-[[2-(cyclooctylamino)-2-oxoethyl]thio]-N-(3-methylbutyl)benzamide IUPAC Name: 2-[2-(cyclooctylamino)-2-oxoethyl]sulfanyl-N-(3-methylbutyl)benzamide Traditional Name: 2-[[2-(cyclooctylamino)-2-keto-ethyl]thio]-N-isoamyl-benzamide Formula: C22H34N2O2S MolecularWeight: 390.58256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC=CC=C1SCC(=O)NC2CCCCCCC2

Isomeric SMILES

CC(C)CCNC(=O)C1=CC=CC=C1SCC(=O)NC2CCCCCCC2

InChI

InChI=1S/C22H34N2O2S/c1-17(2)14-15-23-22(26)19-12-8-9-13-20(19)27-16-21(25)24-18-10-6-4-3-5-7-11-18/h8-9,12-13,17-18H,3-7,10-11,14-16H2,1-2H3,(H,23,26)(H,24,25)