3,4,5-triethoxy-N-[2-(4-phenethylpiperazin-1-yl)sulfonylethyl]benzamide

Systemtic Name: 3,4,5-triethoxy-N-[2-(4-phenethylpiperazin-1-yl)sulfonylethyl]benzamide Openeye Name: 3,4,5-triethoxy-N-[2-(4-phenethylpiperazin-1-yl)sulfonylethyl]benzamide CAS Name: 3,4,5-triethoxy-N-[2-[(4-phenethyl-1-piperazinyl)sulfonyl]ethyl]benzamide IUPAC Name: 3,4,5-triethoxy-N-[2-(4-phenethylpiperazin-1-yl)sulfonylethyl]benzamide Traditional Name: 3,4,5-triethoxy-N-[2-(4-phenethylpiperazino)sulfonylethyl]benzamide Formula: C27H39N3O6S MolecularWeight: 533.68006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NCCS(=O)(=O)N2CCN(CC2)CCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NCCS(=O)(=O)N2CCN(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C27H39N3O6S/c1-4-34-24-20-23(21-25(35-5-2)26(24)36-6-3)27(31)28-13-19-37(32,33)30-17-15-29(16-18-30)14-12-22-10-8-7-9-11-22/h7-11,20-21H,4-6,12-19H2,1-3H3,(H,28,31)