4-[[4-azanyl-6-[[2-bromanyl-4,6-bis(fluoranyl)phenyl]amino]-1,3,5-triazin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-azanyl-6-[[2-bromanyl-4,6-bis(fluoranyl)phenyl]amino]-1,3,5-triazin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-amino-6-(2-bromo-4,6-difluoro-anilino)-1,3,5-triazin-2-yl]amino]benzonitrile CAS Name: 4-[[4-amino-6-(2-bromo-4,6-difluoroanilino)-1,3,5-triazin-2-yl]amino]benzonitrile IUPAC Name: 4-[[4-amino-6-(2-bromo-4,6-difluoroanilino)-1,3,5-triazin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-amino-6-(2-bromo-4,6-difluoro-anilino)-s-triazin-2-yl]amino]benzonitrile Formula: C16H10BrF2N7 MolecularWeight: 418.198306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC2=NC(=NC(=N2)N)NC3=C(C=C(C=C3Br)F)F

Isomeric SMILES

C1=CC(=CC=C1C#N)NC2=NC(=NC(=N2)N)NC3=C(C=C(C=C3Br)F)F

InChI

InChI=1S/C16H10BrF2N7/c17-11-5-9(18)6-12(19)13(11)23-16-25-14(21)24-15(26-16)22-10-3-1-8(7-20)2-4-10/h1-6H,(H4,21,22,23,24,25,26)