N4-cyclohexyl-N4-methyl-N1-(2-pyridin-4-ylethyl)benzene-1,4-disulfonamide

Systemtic Name: N4-cyclohexyl-N4-methyl-N1-(2-pyridin-4-ylethyl)benzene-1,4-disulfonamide Openeye Name: N4-cyclohexyl-N4-methyl-N1-[2-(4-pyridyl)ethyl]benzene-1,4-disulfonamide CAS Name: N4-cyclohexyl-N4-methyl-N1-(2-pyridin-4-ylethyl)benzene-1,4-disulfonamide IUPAC Name: 4-N-cyclohexyl-4-N-methyl-1-N-(2-pyridin-4-ylethyl)benzene-1,4-disulfonamide Traditional Name: N'-cyclohexyl-N'-methyl-N-[2-(4-pyridyl)ethyl]benzene-1,4-disulfonamide Formula: C20H27N3O4S2 MolecularWeight: 437.57608

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC3=CC=NC=C3

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC3=CC=NC=C3

InChI

InChI=1S/C20H27N3O4S2/c1-23(18-5-3-2-4-6-18)29(26,27)20-9-7-19(8-10-20)28(24,25)22-16-13-17-11-14-21-15-12-17/h7-12,14-15,18,22H,2-6,13,16H2,1H3