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

Systemtic Name: N-[(4-methoxyphenyl)methyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[(4-methoxyphenyl)methyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-[(4-methoxyphenyl)methyl]-3-[(4-methylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: 3-[(4-mesylpiperazino)methyl]-N-p-anisyl-benzamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O4S/c1-28-20-8-6-17(7-9-20)15-22-21(25)19-5-3-4-18(14-19)16-23-10-12-24(13-11-23)29(2,26)27/h3-9,14H,10-13,15-16H2,1-2H3,(H,22,25)