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

Systemtic Name: N-[(2S)-1-azanyl-3,3-dimethyl-1-oxidanylidene-butan-2-yl]-1-[(4-cyano-2-fluoranyl-phenyl)methyl]indazole-3-carboxamide Openeye Name: N-[(1S)-1-carbamoyl-2,2-dimethyl-propyl]-1-[(4-cyano-2-fluoro-phenyl)methyl]indazole-3-carboxamide CAS Name: N-[(2S)-1-amino-3,3-dimethyl-1-oxobutan-2-yl]-1-[(4-cyano-2-fluorophenyl)methyl]-3-indazolecarboxamide IUPAC Name: N-[(2S)-1-amino-3,3-dimethyl-1-oxobutan-2-yl]-1-[(4-cyano-2-fluorophenyl)methyl]indazole-3-carboxamide Traditional Name: N-[(1S)-1-carbamoyl-2,2-dimethyl-propyl]-1-(4-cyano-2-fluoro-benzyl)indazole-3-carboxamide Formula: C22H22FN5O2 MolecularWeight: 407.440783

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C22H22FN5O2/c1-22(2,3)19(20(25)29)26-21(30)18-15-6-4-5-7-17(15)28(27-18)12-14-9-8-13(11-24)10-16(14)23/h4-10,19H,12H2,1-3H3,(H2,25,29)(H,26,30)/t19-/m1/s1