4-azanyl-5-[4-[[4,6-bis(fluoranyl)-1H-benzimidazol-2-yl]amino]phenyl]pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid

Systemtic Name: 4-azanyl-5-[4-[[4,6-bis(fluoranyl)-1H-benzimidazol-2-yl]amino]phenyl]pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid Openeye Name: 4-amino-5-[4-[(4,6-difluoro-1H-benzimidazol-2-yl)amino]phenyl]pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid CAS Name: 4-amino-5-[4-[(4,6-difluoro-1H-benzimidazol-2-yl)amino]phenyl]-6-pyrrolo[2,1-f][1,2,4]triazinecarboxylic acid IUPAC Name: 4-amino-5-[4-[(4,6-difluoro-1H-benzimidazol-2-yl)amino]phenyl]pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid Traditional Name: 4-amino-5-[4-[(4,6-difluoro-1H-benzimidazol-2-yl)amino]phenyl]pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid Formula: C20H13F2N7O2 MolecularWeight: 421.359726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C(=NC=NN3C=C2C(=O)O)N)NC4=NC5=C(C=C(C=C5N4)F)F

Isomeric SMILES

C1=CC(=CC=C1C2=C3C(=NC=NN3C=C2C(=O)O)N)NC4=NC5=C(C=C(C=C5N4)F)F

InChI

InChI=1S/C20H13F2N7O2/c21-10-5-13(22)16-14(6-10)27-20(28-16)26-11-3-1-9(2-4-11)15-12(19(30)31)7-29-17(15)18(23)24-8-25-29/h1-8H,(H,30,31)(H2,23,24,25)(H2,26,27,28)