1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)ethanone

Systemtic Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)ethanone Openeye Name: 2-(5-morpholinosulfonyl-2-thienyl)-1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethanone CAS Name: 1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-[5-(4-morpholinylsulfonyl)-2-thiophenyl]ethanone IUPAC Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)ethanone Traditional Name: 2-(5-morpholinosulfonyl-2-thienyl)-1-(4-tosylpiperazino)ethanone Formula: C21H27N3O6S3 MolecularWeight: 513.65058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC3=CC=C(S3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC3=CC=C(S3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H27N3O6S3/c1-17-2-5-19(6-3-17)32(26,27)23-10-8-22(9-11-23)20(25)16-18-4-7-21(31-18)33(28,29)24-12-14-30-15-13-24/h2-7H,8-16H2,1H3