pentyl 2-[1-(4-acetamidophenyl)sulfonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: pentyl 2-[1-(4-acetamidophenyl)sulfonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: pentyl 2-[1-(4-acetamidophenyl)sulfonyl-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-(4-acetamidophenyl)sulfonyl-3-oxo-2-piperazinyl]acetic acid pentyl ester IUPAC Name: pentyl 2-[1-(4-acetamidophenyl)sulfonyl-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(4-acetamidophenyl)sulfonyl-3-keto-piperazin-2-yl]acetic acid amyl ester Formula: C19H27N3O6S MolecularWeight: 425.49918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CC1C(=O)NCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CCCCCOC(=O)CC1C(=O)NCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C19H27N3O6S/c1-3-4-5-12-28-18(24)13-17-19(25)20-10-11-22(17)29(26,27)16-8-6-15(7-9-16)21-14(2)23/h6-9,17H,3-5,10-13H2,1-2H3,(H,20,25)(H,21,23)