1-[4-[[4-(4-ethanoylphenyl)sulfonyl-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanone

Systemtic Name: 1-[4-[[4-(4-ethanoylphenyl)sulfonyl-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanone Openeye Name: 1-[4-[[4-(4-acetylphenyl)sulfonyl-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanone CAS Name: 1-[4-[[4-(4-acetylphenyl)sulfonyl-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[[4-(4-acetylphenyl)sulfonyl-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanone Traditional Name: 1-[4-[[4-(4-acetylphenyl)sulfonyl-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanone Formula: C21H24N2O6S2 MolecularWeight: 464.55506

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H24N2O6S2/c1-16(24)18-4-8-20(9-5-18)30(26,27)22-12-3-13-23(15-14-22)31(28,29)21-10-6-19(7-11-21)17(2)25/h4-11H,3,12-15H2,1-2H3