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

Systemtic Name: N-(3-acetamidophenyl)-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-(3-acetamidophenyl)-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-(3-acetamidophenyl)-3-[(4-methylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-(3-acetamidophenyl)-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: N-(3-acetamidophenyl)-3-[(4-mesylpiperazino)methyl]benzamide Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)NC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)NC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C21H26N4O4S/c1-16(26)22-19-7-4-8-20(14-19)23-21(27)18-6-3-5-17(13-18)15-24-9-11-25(12-10-24)30(2,28)29/h3-8,13-14H,9-12,15H2,1-2H3,(H,22,26)(H,23,27)