4-[[5-methyl-4-(methylamino)-6-quinolin-7-yloxy-pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[5-methyl-4-(methylamino)-6-quinolin-7-yloxy-pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[5-methyl-4-(methylamino)-6-(7-quinolyloxy)pyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[5-methyl-4-(methylamino)-6-(7-quinolinyloxy)-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[5-methyl-4-(methylamino)-6-quinolin-7-yloxypyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[5-methyl-4-(methylamino)-6-(7-quinolyloxy)pyrimidin-2-yl]amino]benzonitrile Formula: C22H18N6O MolecularWeight: 382.41792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1OC2=CC3=C(C=CC=N3)C=C2)NC4=CC=C(C=C4)C#N)NC

Isomeric SMILES

CC1=C(N=C(N=C1OC2=CC3=C(C=CC=N3)C=C2)NC4=CC=C(C=C4)C#N)NC

InChI

InChI=1S/C22H18N6O/c1-14-20(24-2)27-22(26-17-8-5-15(13-23)6-9-17)28-21(14)29-18-10-7-16-4-3-11-25-19(16)12-18/h3-12H,1-2H3,(H2,24,26,27,28)