[4-[[2-(1,3-benzodioxol-5-yl)quinolin-4-yl]carbonylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide

Systemtic Name: [4-[[2-(1,3-benzodioxol-5-yl)quinolin-4-yl]carbonylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide Openeye Name: [4-[[2-(1,3-benzodioxol-5-yl)quinoline-4-carbonyl]amino]phenyl]sulfonyl-pyrimidin-2-yl-azanide CAS Name: [4-[[[2-(1,3-benzodioxol-5-yl)-4-quinolinyl]-oxomethyl]amino]phenyl]sulfonyl-(2-pyrimidinyl)azanide IUPAC Name: [4-[[2-(1,3-benzodioxol-5-yl)quinoline-4-carbonyl]amino]phenyl]sulfonyl-pyrimidin-2-ylazanide Traditional Name: [4-[[2-(1,3-benzodioxol-5-yl)quinoline-4-carbonyl]amino]phenyl]sulfonyl-(2-pyrimidyl)azanide Formula: C27H18N5O5S- MolecularWeight: 524.52732

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=CC=C(C=C5)S(=O)(=O)[N-]C6=NC=CC=N6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5=CC=C(C=C5)S(=O)(=O)[N-]C6=NC=CC=N6

InChI

InChI=1S/C27H19N5O5S/c33-26(30-18-7-9-19(10-8-18)38(34,35)32-27-28-12-3-13-29-27)21-15-23(31-22-5-2-1-4-20(21)22)17-6-11-24-25(14-17)37-16-36-24/h1-15H,16H2,(H2,28,29,30,32,33)/p-1