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

Systemtic Name: 4-butoxy-N-[2-(4-methylsulfonylpiperazin-1-yl)sulfonylethyl]benzamide Openeye Name: 4-butoxy-N-[2-(4-methylsulfonylpiperazin-1-yl)sulfonylethyl]benzamide CAS Name: 4-butoxy-N-[2-[(4-methylsulfonyl-1-piperazinyl)sulfonyl]ethyl]benzamide IUPAC Name: 4-butoxy-N-[2-(4-methylsulfonylpiperazin-1-yl)sulfonylethyl]benzamide Traditional Name: 4-butoxy-N-[2-(4-mesylpiperazino)sulfonylethyl]benzamide Formula: C18H29N3O6S2 MolecularWeight: 447.56936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N3O6S2/c1-3-4-14-27-17-7-5-16(6-8-17)18(22)19-9-15-29(25,26)21-12-10-20(11-13-21)28(2,23)24/h5-8H,3-4,9-15H2,1-2H3,(H,19,22)