4-[5-bromanyl-4-(quinolin-6-ylamino)pyrimidin-2-yl]benzenecarbonitrile

Systemtic Name: 4-[5-bromanyl-4-(quinolin-6-ylamino)pyrimidin-2-yl]benzenecarbonitrile Openeye Name: 4-[5-bromo-4-(6-quinolylamino)pyrimidin-2-yl]benzonitrile CAS Name: 4-[5-bromo-4-(6-quinolinylamino)-2-pyrimidinyl]benzonitrile IUPAC Name: 4-[5-bromo-4-(quinolin-6-ylamino)pyrimidin-2-yl]benzonitrile Traditional Name: 4-[5-bromo-4-(6-quinolylamino)pyrimidin-2-yl]benzonitrile Formula: C20H12BrN5 MolecularWeight: 402.24678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)NC3=NC(=NC=C3Br)C4=CC=C(C=C4)C#N)N=C1

Isomeric SMILES

C1=CC2=C(C=CC(=C2)NC3=NC(=NC=C3Br)C4=CC=C(C=C4)C#N)N=C1

InChI

InChI=1S/C20H12BrN5/c21-17-12-24-19(14-5-3-13(11-22)4-6-14)26-20(17)25-16-7-8-18-15(10-16)2-1-9-23-18/h1-10,12H,(H,24,25,26)