6-(benzotriazol-1-yloxy)-2-chloranyl-N-[4-fluoranyl-3-(pyrazin-2-yloxymethyl)phenyl]pyrimidine-4-carboxamide

Systemtic Name: 6-(benzotriazol-1-yloxy)-2-chloranyl-N-[4-fluoranyl-3-(pyrazin-2-yloxymethyl)phenyl]pyrimidine-4-carboxamide Openeye Name: 6-(benzotriazol-1-yloxy)-2-chloro-N-[4-fluoro-3-(pyrazin-2-yloxymethyl)phenyl]pyrimidine-4-carboxamide CAS Name: 6-(1-benzotriazolyloxy)-2-chloro-N-[4-fluoro-3-(2-pyrazinyloxymethyl)phenyl]-4-pyrimidinecarboxamide IUPAC Name: 6-(benzotriazol-1-yloxy)-2-chloro-N-[4-fluoro-3-(pyrazin-2-yloxymethyl)phenyl]pyrimidine-4-carboxamide Traditional Name: 6-(benzotriazol-1-yloxy)-2-chloro-N-[4-fluoro-3-(pyrazin-2-yloxymethyl)phenyl]pyrimidine-4-carboxamide Formula: C22H14ClFN8O3 MolecularWeight: 492.849763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2OC3=NC(=NC(=C3)C(=O)NC4=CC(=C(C=C4)F)COC5=NC=CN=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2OC3=NC(=NC(=C3)C(=O)NC4=CC(=C(C=C4)F)COC5=NC=CN=C5)Cl

InChI

InChI=1S/C22H14ClFN8O3/c23-22-28-17(10-19(29-22)35-32-18-4-2-1-3-16(18)30-31-32)21(33)27-14-5-6-15(24)13(9-14)12-34-20-11-25-7-8-26-20/h1-11H,12H2,(H,27,33)