1-[2-(aminomethyl)phenyl]-N-[2-fluoranyl-6-(2-methylsulfonylphenyl)phenyl]-1,2,3,4-tetrazole-5-carboxamide

Systemtic Name: 1-[2-(aminomethyl)phenyl]-N-[2-fluoranyl-6-(2-methylsulfonylphenyl)phenyl]-1,2,3,4-tetrazole-5-carboxamide Openeye Name: 1-[2-(aminomethyl)phenyl]-N-[2-fluoro-6-(2-methylsulfonylphenyl)phenyl]tetrazole-5-carboxamide CAS Name: 1-[2-(aminomethyl)phenyl]-N-[2-fluoro-6-(2-methylsulfonylphenyl)phenyl]-5-tetrazolecarboxamide IUPAC Name: 1-[2-(aminomethyl)phenyl]-N-[2-fluoro-6-(2-methylsulfonylphenyl)phenyl]tetrazole-5-carboxamide Traditional Name: 1-[2-(aminomethyl)phenyl]-N-[2-fluoro-6-(2-mesylphenyl)phenyl]tetrazole-5-carboxamide Formula: C22H19FN6O3S MolecularWeight: 466.488063

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=C(C(=CC=C2)F)NC(=O)C3=NN=NN3C4=CC=CC=C4CN

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=C(C(=CC=C2)F)NC(=O)C3=NN=NN3C4=CC=CC=C4CN

InChI

InChI=1S/C22H19FN6O3S/c1-33(31,32)19-12-5-3-8-15(19)16-9-6-10-17(23)20(16)25-22(30)21-26-27-28-29(21)18-11-4-2-7-14(18)13-24/h2-12H,13,24H2,1H3,(H,25,30)