2-[2-[(3-ethoxy-4-oxidanyl-phenyl)methyl-ethyl-amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[2-[(3-ethoxy-4-oxidanyl-phenyl)methyl-ethyl-amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methylphenyl)ethanamide Openeye Name: 2-[2-[(3-ethoxy-4-hydroxy-phenyl)methyl-ethyl-amino]-2-oxo-ethyl]sulfanyl-N-(p-tolyl)acetamide CAS Name: 2-[[2-[(3-ethoxy-4-hydroxyphenyl)methyl-ethylamino]-2-oxoethyl]thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[2-[(3-ethoxy-4-hydroxyphenyl)methyl-ethylamino]-2-oxoethyl]sulfanyl-N-(4-methylphenyl)acetamide Traditional Name: 2-[[2-[(3-ethoxy-4-hydroxy-benzyl)-ethyl-amino]-2-keto-ethyl]thio]-N-(p-tolyl)acetamide Formula: C22H28N2O4S MolecularWeight: 416.53372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)O)OCC)C(=O)CSCC(=O)NC2=CC=C(C=C2)C

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)O)OCC)C(=O)CSCC(=O)NC2=CC=C(C=C2)C

InChI

InChI=1S/C22H28N2O4S/c1-4-24(13-17-8-11-19(25)20(12-17)28-5-2)22(27)15-29-14-21(26)23-18-9-6-16(3)7-10-18/h6-12,25H,4-5,13-15H2,1-3H3,(H,23,26)