3,4-dimethyl-N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide

Systemtic Name: 3,4-dimethyl-N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide Openeye Name: 3,4-dimethyl-N-[3-[4-(2-pyridyl)piperazin-1-yl]sulfonylpropyl]benzamide CAS Name: 3,4-dimethyl-N-[3-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]propyl]benzamide IUPAC Name: 3,4-dimethyl-N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide Traditional Name: 3,4-dimethyl-N-[3-[4-(2-pyridyl)piperazino]sulfonylpropyl]benzamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=N3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=N3)C

InChI

InChI=1S/C21H28N4O3S/c1-17-7-8-19(16-18(17)2)21(26)23-10-5-15-29(27,28)25-13-11-24(12-14-25)20-6-3-4-9-22-20/h3-4,6-9,16H,5,10-15H2,1-2H3,(H,23,26)