N-[4-(cyanomethyl)phenyl]-4-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-4-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[4-(cyanomethyl)phenyl]-4-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-4-[(4-methylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-4-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: N-[4-(cyanomethyl)phenyl]-4-[(4-mesylpiperazino)methyl]benzamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C21H24N4O3S/c1-29(27,28)25-14-12-24(13-15-25)16-18-2-6-19(7-3-18)21(26)23-20-8-4-17(5-9-20)10-11-22/h2-9H,10,12-16H2,1H3,(H,23,26)