N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]-2-methyl-benzamide

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]-2-methyl-benzamide Openeye Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]-2-methyl-benzamide CAS Name: N-[3-[[4-(4-methoxyphenyl)-1-piperazinyl]sulfonyl]propyl]-2-methylbenzamide IUPAC Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]-2-methylbenzamide Traditional Name: N-[3-[4-(4-methoxyphenyl)piperazino]sulfonylpropyl]-2-methyl-benzamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H29N3O4S/c1-18-6-3-4-7-21(18)22(26)23-12-5-17-30(27,28)25-15-13-24(14-16-25)19-8-10-20(29-2)11-9-19/h3-4,6-11H,5,12-17H2,1-2H3,(H,23,26)