4-[[4-azanyl-6-(1-bromanylnaphthalen-2-yl)oxy-1,3,5-triazin-2-yl]amino]-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[[4-azanyl-6-(1-bromanylnaphthalen-2-yl)oxy-1,3,5-triazin-2-yl]amino]-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-[[4-amino-6-[(1-bromo-2-naphthyl)oxy]-1,3,5-triazin-2-yl]amino]-3-fluoro-benzonitrile CAS Name: 4-[[4-amino-6-[(1-bromo-2-naphthalenyl)oxy]-1,3,5-triazin-2-yl]amino]-3-fluorobenzonitrile IUPAC Name: 4-[[4-amino-6-(1-bromonaphthalen-2-yl)oxy-1,3,5-triazin-2-yl]amino]-3-fluorobenzonitrile Traditional Name: 4-[[4-amino-6-(1-bromo-2-naphthoxy)-s-triazin-2-yl]amino]-3-fluoro-benzonitrile Formula: C20H12BrFN6O MolecularWeight: 451.251283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2Br)OC3=NC(=NC(=N3)NC4=C(C=C(C=C4)C#N)F)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2Br)OC3=NC(=NC(=N3)NC4=C(C=C(C=C4)C#N)F)N

InChI

InChI=1S/C20H12BrFN6O/c21-17-13-4-2-1-3-12(13)6-8-16(17)29-20-27-18(24)26-19(28-20)25-15-7-5-11(10-23)9-14(15)22/h1-9H,(H3,24,25,26,27,28)