N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[ethyl-(4-methylsulfanylphenyl)sulfonyl-amino]benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[ethyl-(4-methylsulfanylphenyl)sulfonyl-amino]benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[ethyl-(4-methylsulfanylphenyl)sulfonyl-amino]benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[ethyl-[4-(methylthio)phenyl]sulfonylamino]benzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[ethyl-(4-methylsulfanylphenyl)sulfonylamino]benzamide Traditional Name: 4-[ethyl-[4-(methylthio)phenyl]sulfonyl-amino]-N-homoveratryl-benzamide Formula: C26H30N2O5S2 MolecularWeight: 514.6568

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)C(=O)NCCC2=CC(=C(C=C2)OC)OC)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CCN(C1=CC=C(C=C1)C(=O)NCCC2=CC(=C(C=C2)OC)OC)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C26H30N2O5S2/c1-5-28(35(30,31)23-13-11-22(34-4)12-14-23)21-9-7-20(8-10-21)26(29)27-17-16-19-6-15-24(32-2)25(18-19)33-3/h6-15,18H,5,16-17H2,1-4H3,(H,27,29)