2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(2,5-diethoxyphenyl)benzamide

Systemtic Name: 2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(2,5-diethoxyphenyl)benzamide Openeye Name: 2-[2-(cyclooctylamino)-2-oxo-ethyl]sulfanyl-N-(2,5-diethoxyphenyl)benzamide CAS Name: 2-[[2-(cyclooctylamino)-2-oxoethyl]thio]-N-(2,5-diethoxyphenyl)benzamide IUPAC Name: 2-[2-(cyclooctylamino)-2-oxoethyl]sulfanyl-N-(2,5-diethoxyphenyl)benzamide Traditional Name: 2-[[2-(cyclooctylamino)-2-keto-ethyl]thio]-N-(2,5-diethoxyphenyl)benzamide Formula: C27H36N2O4S MolecularWeight: 484.65074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2=CC=CC=C2SCC(=O)NC3CCCCCCC3

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2=CC=CC=C2SCC(=O)NC3CCCCCCC3

InChI

InChI=1S/C27H36N2O4S/c1-3-32-21-16-17-24(33-4-2)23(18-21)29-27(31)22-14-10-11-15-25(22)34-19-26(30)28-20-12-8-6-5-7-9-13-20/h10-11,14-18,20H,3-9,12-13,19H2,1-2H3,(H,28,30)(H,29,31)