2-ethylsulfanyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylethyl]benzamide

Systemtic Name: 2-ethylsulfanyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylethyl]benzamide Openeye Name: 2-ethylsulfanyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylethyl]benzamide CAS Name: 2-(ethylthio)-N-[2-[[4-(2-methoxyphenyl)-1-piperazinyl]sulfonyl]ethyl]benzamide IUPAC Name: 2-ethylsulfanyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylethyl]benzamide Traditional Name: 2-(ethylthio)-N-[2-[4-(2-methoxyphenyl)piperazino]sulfonylethyl]benzamide Formula: C22H29N3O4S2 MolecularWeight: 463.61336

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C22H29N3O4S2/c1-3-30-21-11-7-4-8-18(21)22(26)23-12-17-31(27,28)25-15-13-24(14-16-25)19-9-5-6-10-20(19)29-2/h4-11H,3,12-17H2,1-2H3,(H,23,26)