N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-(2-methylphenyl)sulfanyl-ethanamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-(2-methylphenyl)sulfanyl-ethanamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-(o-tolylsulfanyl)acetamide CAS Name: N-[4-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-2-[(2-methylphenyl)thio]acetamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-(2-methylphenyl)sulfanylacetamide Traditional Name: N-[4-(4-ethylpiperazino)sulfonylphenyl]-2-(o-tolylthio)acetamide Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=CC=CC=C3C

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=CC=CC=C3C

InChI

InChI=1S/C21H27N3O3S2/c1-3-23-12-14-24(15-13-23)29(26,27)19-10-8-18(9-11-19)22-21(25)16-28-20-7-5-4-6-17(20)2/h4-11H,3,12-16H2,1-2H3,(H,22,25)