N-(2-azanylethyl)-2-(3-methoxy-4-sulfanyl-phenyl)-N-octyl-ethanamide

Systemtic Name: N-(2-azanylethyl)-2-(3-methoxy-4-sulfanyl-phenyl)-N-octyl-ethanamide Openeye Name: N-(2-aminoethyl)-2-(3-methoxy-4-sulfanyl-phenyl)-N-octyl-acetamide CAS Name: N-(2-aminoethyl)-2-(4-mercapto-3-methoxyphenyl)-N-octylacetamide IUPAC Name: N-(2-aminoethyl)-2-(3-methoxy-4-sulfanylphenyl)-N-octylacetamide Traditional Name: N-(2-aminoethyl)-2-(4-mercapto-3-methoxy-phenyl)-N-octyl-acetamide Formula: C19H32N2O2S MolecularWeight: 352.53458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCN)C(=O)CC1=CC(=C(C=C1)S)OC

Isomeric SMILES

CCCCCCCCN(CCN)C(=O)CC1=CC(=C(C=C1)S)OC

InChI

InChI=1S/C19H32N2O2S/c1-3-4-5-6-7-8-12-21(13-11-20)19(22)15-16-9-10-18(24)17(14-16)23-2/h9-10,14,24H,3-8,11-13,15,20H2,1-2H3