1-(4-methylsulfonylphenyl)-4-(2-methylsulfonylphenyl)sulfonyl-1,4-diazepane

Systemtic Name: 1-(4-methylsulfonylphenyl)-4-(2-methylsulfonylphenyl)sulfonyl-1,4-diazepane Openeye Name: 1-(4-methylsulfonylphenyl)-4-(2-methylsulfonylphenyl)sulfonyl-1,4-diazepane CAS Name: 1-(4-methylsulfonylphenyl)-4-(2-methylsulfonylphenyl)sulfonyl-1,4-diazepane IUPAC Name: 1-(4-methylsulfonylphenyl)-4-(2-methylsulfonylphenyl)sulfonyl-1,4-diazepane Traditional Name: 1-(4-mesylphenyl)-4-(2-mesylphenyl)sulfonyl-1,4-diazepane Formula: C19H24N2O6S3 MolecularWeight: 472.59866

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2CCCN(CC2)S(=O)(=O)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2CCCN(CC2)S(=O)(=O)C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C19H24N2O6S3/c1-28(22,23)17-10-8-16(9-11-17)20-12-5-13-21(15-14-20)30(26,27)19-7-4-3-6-18(19)29(2,24)25/h3-4,6-11H,5,12-15H2,1-2H3