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

Systemtic Name: N1-[[(2R)-oxolan-2-yl]methyl]-N4-(pyridin-4-ylmethyl)benzene-1,4-disulfonamide Openeye Name: N4-(4-pyridylmethyl)-N1-[[(2R)-tetrahydrofuran-2-yl]methyl]benzene-1,4-disulfonamide CAS Name: N1-[[(2R)-2-oxolanyl]methyl]-N4-(pyridin-4-ylmethyl)benzene-1,4-disulfonamide IUPAC Name: 1-N-[[(2R)-oxolan-2-yl]methyl]-4-N-(pyridin-4-ylmethyl)benzene-1,4-disulfonamide Traditional Name: N'-(4-pyridylmethyl)-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzene-1,4-disulfonamide Formula: C17H21N3O5S2 MolecularWeight: 411.49574

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=NC=C3

Isomeric SMILES

C1C[C@@H](OC1)CNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C17H21N3O5S2/c21-26(22,19-12-14-7-9-18-10-8-14)16-3-5-17(6-4-16)27(23,24)20-13-15-2-1-11-25-15/h3-10,15,19-20H,1-2,11-13H2/t15-/m1/s1