1-[(4-cyano-2-fluoranyl-phenyl)methyl]-N-[(2S)-1-(2-hydroxyethylamino)-3,3-dimethyl-1-oxidanylidene-butan-2-yl]indazole-3-carboxamide

Systemtic Name: 1-[(4-cyano-2-fluoranyl-phenyl)methyl]-N-[(2S)-1-(2-hydroxyethylamino)-3,3-dimethyl-1-oxidanylidene-butan-2-yl]indazole-3-carboxamide Openeye Name: 1-[(4-cyano-2-fluoro-phenyl)methyl]-N-[(1S)-1-(2-hydroxyethylcarbamoyl)-2,2-dimethyl-propyl]indazole-3-carboxamide CAS Name: 1-[(4-cyano-2-fluorophenyl)methyl]-N-[(2S)-1-(2-hydroxyethylamino)-3,3-dimethyl-1-oxobutan-2-yl]-3-indazolecarboxamide IUPAC Name: 1-[(4-cyano-2-fluorophenyl)methyl]-N-[(2S)-1-(2-hydroxyethylamino)-3,3-dimethyl-1-oxobutan-2-yl]indazole-3-carboxamide Traditional Name: 1-(4-cyano-2-fluoro-benzyl)-N-[(1S)-1-(2-hydroxyethylcarbamoyl)-2,2-dimethyl-propyl]indazole-3-carboxamide Formula: C24H26FN5O3 MolecularWeight: 451.493343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)NCCO)NC(=O)C1=NN(C2=CC=CC=C21)CC3=C(C=C(C=C3)C#N)F

Isomeric SMILES

CC(C)(C)[C@@H](C(=O)NCCO)NC(=O)C1=NN(C2=CC=CC=C21)CC3=C(C=C(C=C3)C#N)F

InChI

InChI=1S/C24H26FN5O3/c1-24(2,3)21(23(33)27-10-11-31)28-22(32)20-17-6-4-5-7-19(17)30(29-20)14-16-9-8-15(13-26)12-18(16)25/h4-9,12,21,31H,10-11,14H2,1-3H3,(H,27,33)(H,28,32)/t21-/m1/s1