2-(1,3-benzodioxol-5-yl)-3-fluoranyl-N6-methyl-N4-pyridin-4-yl-quinoline-4,6-diamine

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-3-fluoranyl-N6-methyl-N4-pyridin-4-yl-quinoline-4,6-diamine Openeye Name: 2-(1,3-benzodioxol-5-yl)-3-fluoro-N6-methyl-N4-(4-pyridyl)quinoline-4,6-diamine CAS Name: 2-(1,3-benzodioxol-5-yl)-3-fluoro-N6-methyl-N4-pyridin-4-ylquinoline-4,6-diamine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-3-fluoro-6-N-methyl-4-N-pyridin-4-ylquinoline-4,6-diamine Traditional Name: [2-(1,3-benzodioxol-5-yl)-3-fluoro-6-(methylamino)-4-quinolyl]-(4-pyridyl)amine Formula: C22H17FN4O2 MolecularWeight: 388.394383

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC2=C(C=C1)N=C(C(=C2NC3=CC=NC=C3)F)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CNC1=CC2=C(C=C1)N=C(C(=C2NC3=CC=NC=C3)F)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H17FN4O2/c1-24-15-3-4-17-16(11-15)22(26-14-6-8-25-9-7-14)20(23)21(27-17)13-2-5-18-19(10-13)29-12-28-18/h2-11,24H,12H2,1H3,(H,25,26,27)