N-[2-(4-methoxyphenyl)ethyl]-4-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-4-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-4-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-4-[(4-methylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-4-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: 4-[(4-mesylpiperazino)methyl]-N-[2-(4-methoxyphenyl)ethyl]benzamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C

InChI

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