4-butoxy-N-[2-(4-phenylpiperazin-1-yl)sulfonylethyl]benzamide

Systemtic Name: 4-butoxy-N-[2-(4-phenylpiperazin-1-yl)sulfonylethyl]benzamide Openeye Name: 4-butoxy-N-[2-(4-phenylpiperazin-1-yl)sulfonylethyl]benzamide CAS Name: 4-butoxy-N-[2-[(4-phenyl-1-piperazinyl)sulfonyl]ethyl]benzamide IUPAC Name: 4-butoxy-N-[2-(4-phenylpiperazin-1-yl)sulfonylethyl]benzamide Traditional Name: 4-butoxy-N-[2-(4-phenylpiperazino)sulfonylethyl]benzamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C23H31N3O4S/c1-2-3-18-30-22-11-9-20(10-12-22)23(27)24-13-19-31(28,29)26-16-14-25(15-17-26)21-7-5-4-6-8-21/h4-12H,2-3,13-19H2,1H3,(H,24,27)