2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-N-methyl-N-[(4-prop-2-enoxyphenyl)methyl]benzamide

Systemtic Name: 2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-N-methyl-N-[(4-prop-2-enoxyphenyl)methyl]benzamide Openeye Name: N-[(4-allyloxyphenyl)methyl]-2-[2-(cyclooctylamino)-2-oxo-ethyl]sulfanyl-N-methyl-benzamide CAS Name: 2-[[2-(cyclooctylamino)-2-oxoethyl]thio]-N-methyl-N-[(4-prop-2-enoxyphenyl)methyl]benzamide IUPAC Name: 2-[2-(cyclooctylamino)-2-oxoethyl]sulfanyl-N-methyl-N-[(4-prop-2-enoxyphenyl)methyl]benzamide Traditional Name: N-(4-allyloxybenzyl)-2-[[2-(cyclooctylamino)-2-keto-ethyl]thio]-N-methyl-benzamide Formula: C28H36N2O3S MolecularWeight: 480.66204

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)OCC=C)C(=O)C2=CC=CC=C2SCC(=O)NC3CCCCCCC3

Isomeric SMILES

CN(CC1=CC=C(C=C1)OCC=C)C(=O)C2=CC=CC=C2SCC(=O)NC3CCCCCCC3

InChI

InChI=1S/C28H36N2O3S/c1-3-19-33-24-17-15-22(16-18-24)20-30(2)28(32)25-13-9-10-14-26(25)34-21-27(31)29-23-11-7-5-4-6-8-12-23/h3,9-10,13-18,23H,1,4-8,11-12,19-21H2,2H3,(H,29,31)