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

Systemtic Name: 2-methylsulfanyl-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]benzamide Openeye Name: 2-methylsulfanyl-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]benzamide CAS Name: 2-(methylthio)-N-[3-[(4-phenyl-1-piperazinyl)sulfonyl]propyl]benzamide IUPAC Name: 2-methylsulfanyl-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]benzamide Traditional Name: 2-(methylthio)-N-[3-(4-phenylpiperazino)sulfonylpropyl]benzamide Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3S2/c1-28-20-11-6-5-10-19(20)21(25)22-12-7-17-29(26,27)24-15-13-23(14-16-24)18-8-3-2-4-9-18/h2-6,8-11H,7,12-17H2,1H3,(H,22,25)