N-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propyl]benzamide

Systemtic Name: N-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propyl]benzamide Openeye Name: N-[3-[4-(p-tolylsulfonyl)piperazin-1-yl]propyl]benzamide CAS Name: N-[3-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]propyl]benzamide IUPAC Name: N-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propyl]benzamide Traditional Name: N-[3-(4-tosylpiperazino)propyl]benzamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CCCNC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CCCNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3S/c1-18-8-10-20(11-9-18)28(26,27)24-16-14-23(15-17-24)13-5-12-22-21(25)19-6-3-2-4-7-19/h2-4,6-11H,5,12-17H2,1H3,(H,22,25)