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

Systemtic Name: N1-cyclopropyl-N4-[(4-methoxyphenyl)methyl]-N4-(pyridin-2-ylmethyl)benzene-1,4-disulfonamide Openeye Name: N1-cyclopropyl-N4-[(4-methoxyphenyl)methyl]-N4-(2-pyridylmethyl)benzene-1,4-disulfonamide CAS Name: N1-cyclopropyl-N4-[(4-methoxyphenyl)methyl]-N4-(2-pyridinylmethyl)benzene-1,4-disulfonamide IUPAC Name: 1-N-cyclopropyl-4-N-[(4-methoxyphenyl)methyl]-4-N-(pyridin-2-ylmethyl)benzene-1,4-disulfonamide Traditional Name: N-cyclopropyl-N'-p-anisyl-N'-(2-pyridylmethyl)benzene-1,4-disulfonamide Formula: C23H25N3O5S2 MolecularWeight: 487.5917

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CC2=CC=CC=N2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4

Isomeric SMILES

COC1=CC=C(C=C1)CN(CC2=CC=CC=N2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4

InChI

InChI=1S/C23H25N3O5S2/c1-31-21-9-5-18(6-10-21)16-26(17-20-4-2-3-15-24-20)33(29,30)23-13-11-22(12-14-23)32(27,28)25-19-7-8-19/h2-6,9-15,19,25H,7-8,16-17H2,1H3