3-[[4-(quinolin-6-ylamino)pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 3-[[4-(quinolin-6-ylamino)pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 3-[[4-(6-quinolylamino)pyrimidin-2-yl]amino]benzonitrile CAS Name: 3-[[4-(6-quinolinylamino)-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 3-[[4-(quinolin-6-ylamino)pyrimidin-2-yl]amino]benzonitrile Traditional Name: 3-[[4-(6-quinolylamino)pyrimidin-2-yl]amino]benzonitrile Formula: C20H14N6 MolecularWeight: 338.36536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC=CC(=N2)NC3=CC4=C(C=C3)N=CC=C4)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC=CC(=N2)NC3=CC4=C(C=C3)N=CC=C4)C#N

InChI

InChI=1S/C20H14N6/c21-13-14-3-1-5-16(11-14)25-20-23-10-8-19(26-20)24-17-6-7-18-15(12-17)4-2-9-22-18/h1-12H,(H2,23,24,25,26)