3-[1-(6-bromanylquinazolin-4-yl)piperidin-4-yl]oxybenzenecarbonitrile

Systemtic Name: 3-[1-(6-bromanylquinazolin-4-yl)piperidin-4-yl]oxybenzenecarbonitrile Openeye Name: 3-[[1-(6-bromoquinazolin-4-yl)-4-piperidyl]oxy]benzonitrile CAS Name: 3-[[1-(6-bromo-4-quinazolinyl)-4-piperidinyl]oxy]benzonitrile IUPAC Name: 3-[1-(6-bromoquinazolin-4-yl)piperidin-4-yl]oxybenzonitrile Traditional Name: 3-[[1-(6-bromoquinazolin-4-yl)-4-piperidyl]oxy]benzonitrile Formula: C20H17BrN4O MolecularWeight: 409.27918

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC=CC(=C2)C#N)C3=NC=NC4=C3C=C(C=C4)Br

Isomeric SMILES

C1CN(CCC1OC2=CC=CC(=C2)C#N)C3=NC=NC4=C3C=C(C=C4)Br

InChI

InChI=1S/C20H17BrN4O/c21-15-4-5-19-18(11-15)20(24-13-23-19)25-8-6-16(7-9-25)26-17-3-1-2-14(10-17)12-22/h1-5,10-11,13,16H,6-9H2