3-[[(E)-[2-(1,3-benzodioxol-5-ylmethyl)-1,3-bis(oxidanylidene)isoquinolin-4-ylidene]methyl]amino]-N-(furan-2-ylmethyl)benzenesulfonamide

Systemtic Name: 3-[[(E)-[2-(1,3-benzodioxol-5-ylmethyl)-1,3-bis(oxidanylidene)isoquinolin-4-ylidene]methyl]amino]-N-(furan-2-ylmethyl)benzenesulfonamide Openeye Name: 3-[[(E)-[2-(1,3-benzodioxol-5-ylmethyl)-1,3-dioxo-4-isoquinolylidene]methyl]amino]-N-(2-furylmethyl)benzenesulfonamide CAS Name: 3-[[(E)-[2-(1,3-benzodioxol-5-ylmethyl)-1,3-dioxo-4-isoquinolinylidene]methyl]amino]-N-(2-furanylmethyl)benzenesulfonamide IUPAC Name: 3-[[(E)-[2-(1,3-benzodioxol-5-ylmethyl)-1,3-dioxoisoquinolin-4-ylidene]methyl]amino]-N-(furan-2-ylmethyl)benzenesulfonamide Traditional Name: 3-[[(E)-(1,3-diketo-2-piperonyl-4-isoquinolylidene)methyl]amino]-N-(2-furfuryl)benzenesulfonamide Formula: C29H23N3O7S MolecularWeight: 557.57382

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=CC=CC=C4C(=CNC5=CC(=CC=C5)S(=O)(=O)NCC6=CC=CO6)C3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=CC=CC=C4/C(=C\NC5=CC(=CC=C5)S(=O)(=O)NCC6=CC=CO6)/C3=O

InChI

InChI=1S/C29H23N3O7S/c33-28-24-9-2-1-8-23(24)25(29(34)32(28)17-19-10-11-26-27(13-19)39-18-38-26)16-30-20-5-3-7-22(14-20)40(35,36)31-15-21-6-4-12-37-21/h1-14,16,30-31H,15,17-18H2/b25-16+