3-cyano-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]benzamide

Systemtic Name: 3-cyano-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]benzamide Openeye Name: 3-cyano-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]benzamide CAS Name: 3-cyano-N-[3-[(4-phenyl-1-piperazinyl)sulfonyl]propyl]benzamide IUPAC Name: 3-cyano-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]benzamide Traditional Name: 3-cyano-N-[3-(4-phenylpiperazino)sulfonylpropyl]benzamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)CCCNC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)CCCNC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H24N4O3S/c22-17-18-6-4-7-19(16-18)21(26)23-10-5-15-29(27,28)25-13-11-24(12-14-25)20-8-2-1-3-9-20/h1-4,6-9,16H,5,10-15H2,(H,23,26)