N4-[cyclopropyl(pyridin-2-yl)methyl]-N1-(oxolan-2-ylmethyl)benzene-1,4-disulfonamide

Systemtic Name: N4-[cyclopropyl(pyridin-2-yl)methyl]-N1-(oxolan-2-ylmethyl)benzene-1,4-disulfonamide Openeye Name: N4-[cyclopropyl(2-pyridyl)methyl]-N1-(tetrahydrofuran-2-ylmethyl)benzene-1,4-disulfonamide CAS Name: N4-[cyclopropyl(2-pyridinyl)methyl]-N1-(2-oxolanylmethyl)benzene-1,4-disulfonamide IUPAC Name: 4-N-[cyclopropyl(pyridin-2-yl)methyl]-1-N-(oxolan-2-ylmethyl)benzene-1,4-disulfonamide Traditional Name: N'-[cyclopropyl(2-pyridyl)methyl]-N-(tetrahydrofurfuryl)benzene-1,4-disulfonamide Formula: C20H25N3O5S2 MolecularWeight: 451.5596

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC(C3CC3)C4=CC=CC=N4

Isomeric SMILES

C1CC(OC1)CNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC(C3CC3)C4=CC=CC=N4

InChI

InChI=1S/C20H25N3O5S2/c24-29(25,22-14-16-4-3-13-28-16)17-8-10-18(11-9-17)30(26,27)23-20(15-6-7-15)19-5-1-2-12-21-19/h1-2,5,8-12,15-16,20,22-23H,3-4,6-7,13-14H2