N1-butyl-N4-(pyridin-4-ylmethyl)benzene-1,4-disulfonamide

Systemtic Name: N1-butyl-N4-(pyridin-4-ylmethyl)benzene-1,4-disulfonamide Openeye Name: N1-butyl-N4-(4-pyridylmethyl)benzene-1,4-disulfonamide CAS Name: N1-butyl-N4-(pyridin-4-ylmethyl)benzene-1,4-disulfonamide IUPAC Name: 1-N-butyl-4-N-(pyridin-4-ylmethyl)benzene-1,4-disulfonamide Traditional Name: N-butyl-N'-(4-pyridylmethyl)benzene-1,4-disulfonamide Formula: C16H21N3O4S2 MolecularWeight: 383.48564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=NC=C2

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=NC=C2

InChI

InChI=1S/C16H21N3O4S2/c1-2-3-10-18-24(20,21)15-4-6-16(7-5-15)25(22,23)19-13-14-8-11-17-12-9-14/h4-9,11-12,18-19H,2-3,10,13H2,1H3