1-(3-azanyl-1,2-benzoxazol-5-yl)-N-(2-fluoranyl-4-pyrrolidin-1-ylcarbonyl-phenyl)-1,2,3,4-tetrazole-5-carboxamide

Systemtic Name: 1-(3-azanyl-1,2-benzoxazol-5-yl)-N-(2-fluoranyl-4-pyrrolidin-1-ylcarbonyl-phenyl)-1,2,3,4-tetrazole-5-carboxamide Openeye Name: 1-(3-amino-1,2-benzoxazol-5-yl)-N-[2-fluoro-4-(pyrrolidine-1-carbonyl)phenyl]tetrazole-5-carboxamide CAS Name: 1-(3-amino-1,2-benzoxazol-5-yl)-N-[2-fluoro-4-[oxo(1-pyrrolidinyl)methyl]phenyl]-5-tetrazolecarboxamide IUPAC Name: 1-(3-amino-1,2-benzoxazol-5-yl)-N-[2-fluoro-4-(pyrrolidine-1-carbonyl)phenyl]tetrazole-5-carboxamide Traditional Name: 1-(3-aminoindoxazen-5-yl)-N-[2-fluoro-4-(pyrrolidine-1-carbonyl)phenyl]tetrazole-5-carboxamide Formula: C20H17FN8O3 MolecularWeight: 436.399183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=C(C=C2)NC(=O)C3=NN=NN3C4=CC5=C(C=C4)ON=C5N)F

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=C(C=C2)NC(=O)C3=NN=NN3C4=CC5=C(C=C4)ON=C5N)F

InChI

InChI=1S/C20H17FN8O3/c21-14-9-11(20(31)28-7-1-2-8-28)3-5-15(14)23-19(30)18-24-26-27-29(18)12-4-6-16-13(10-12)17(22)25-32-16/h3-6,9-10H,1-2,7-8H2,(H2,22,25)(H,23,30)