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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

InChI

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