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

Systemtic Name: 2-(3-azanyl-1,2-benzoxazol-5-yl)-5-ethyl-N-(2-fluoranyl-4-pyrrolidin-1-ylcarbonyl-phenyl)pyrazole-3-carboxamide Openeye Name: 2-(3-amino-1,2-benzoxazol-5-yl)-5-ethyl-N-[2-fluoro-4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxamide CAS Name: 2-(3-amino-1,2-benzoxazol-5-yl)-5-ethyl-N-[2-fluoro-4-[oxo(1-pyrrolidinyl)methyl]phenyl]-3-pyrazolecarboxamide IUPAC Name: 2-(3-amino-1,2-benzoxazol-5-yl)-5-ethyl-N-[2-fluoro-4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxamide Traditional Name: 2-(3-aminoindoxazen-5-yl)-5-ethyl-N-[2-fluoro-4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxamide Formula: C24H23FN6O3 MolecularWeight: 462.476223

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)C(=O)NC2=C(C=C(C=C2)C(=O)N3CCCC3)F)C4=CC5=C(C=C4)ON=C5N

Isomeric SMILES

CCC1=NN(C(=C1)C(=O)NC2=C(C=C(C=C2)C(=O)N3CCCC3)F)C4=CC5=C(C=C4)ON=C5N

InChI

InChI=1S/C24H23FN6O3/c1-2-15-12-20(31(28-15)16-6-8-21-17(13-16)22(26)29-34-21)23(32)27-19-7-5-14(11-18(19)25)24(33)30-9-3-4-10-30/h5-8,11-13H,2-4,9-10H2,1H3,(H2,26,29)(H,27,32)