N1-cyclopropyl-N4-[(4-ethoxyphenyl)methyl]-N4-(phenylmethyl)benzene-1,4-disulfonamide

Systemtic Name: N1-cyclopropyl-N4-[(4-ethoxyphenyl)methyl]-N4-(phenylmethyl)benzene-1,4-disulfonamide Openeye Name: N4-benzyl-N1-cyclopropyl-N4-[(4-ethoxyphenyl)methyl]benzene-1,4-disulfonamide CAS Name: N1-cyclopropyl-N4-[(4-ethoxyphenyl)methyl]-N4-(phenylmethyl)benzene-1,4-disulfonamide IUPAC Name: 4-N-benzyl-1-N-cyclopropyl-4-N-[(4-ethoxyphenyl)methyl]benzene-1,4-disulfonamide Traditional Name: N'-benzyl-N-cyclopropyl-N'-(4-ethoxybenzyl)benzene-1,4-disulfonamide Formula: C25H28N2O5S2 MolecularWeight: 500.63022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4

Isomeric SMILES

CCOC1=CC=C(C=C1)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4

InChI

InChI=1S/C25H28N2O5S2/c1-2-32-23-12-8-21(9-13-23)19-27(18-20-6-4-3-5-7-20)34(30,31)25-16-14-24(15-17-25)33(28,29)26-22-10-11-22/h3-9,12-17,22,26H,2,10-11,18-19H2,1H3