N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-[(3-methylphenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-[(3-methylphenyl)methylsulfanyl]ethanamide Openeye Name: N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-(m-tolylmethylsulfanyl)acetamide CAS Name: N-[3-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-2-[(3-methylphenyl)methylthio]acetamide IUPAC Name: N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-[(3-methylphenyl)methylsulfanyl]acetamide Traditional Name: N-[3-(4-ethylpiperazino)sulfonylphenyl]-2-[(3-methylbenzyl)thio]acetamide Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSCC3=CC=CC(=C3)C

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSCC3=CC=CC(=C3)C

InChI

InChI=1S/C22H29N3O3S2/c1-3-24-10-12-25(13-11-24)30(27,28)21-9-5-8-20(15-21)23-22(26)17-29-16-19-7-4-6-18(2)14-19/h4-9,14-15H,3,10-13,16-17H2,1-2H3,(H,23,26)