2-(phenylmethylsulfanyl)-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]ethanamide

Systemtic Name: 2-(phenylmethylsulfanyl)-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]ethanamide Openeye Name: 2-benzylsulfanyl-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]acetamide CAS Name: 2-(phenylmethylthio)-N-[3-[(4-phenyl-1-piperazinyl)sulfonyl]propyl]acetamide IUPAC Name: 2-benzylsulfanyl-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]acetamide Traditional Name: 2-(benzylthio)-N-[3-(4-phenylpiperazino)sulfonylpropyl]acetamide Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)CCCNC(=O)CSCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)CCCNC(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3S2/c26-22(19-29-18-20-8-3-1-4-9-20)23-12-7-17-30(27,28)25-15-13-24(14-16-25)21-10-5-2-6-11-21/h1-6,8-11H,7,12-19H2,(H,23,26)