N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]ethanamide Openeye Name: N-(2-methylsulfanylphenyl)-2-(4-styrylsulfonylpiperazin-1-yl)acetamide CAS Name: N-[2-(methylthio)phenyl]-2-[4-(2-phenylethenylsulfonyl)-1-piperazinyl]acetamide IUPAC Name: N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide Traditional Name: N-[2-(methylthio)phenyl]-2-(4-styrylsulfonylpiperazino)acetamide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)CN2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)CN2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O3S2/c1-28-20-10-6-5-9-19(20)22-21(25)17-23-12-14-24(15-13-23)29(26,27)16-11-18-7-3-2-4-8-18/h2-11,16H,12-15,17H2,1H3,(H,22,25)