1-(3-cyano-4-fluoranyl-phenyl)-5-[[5-(2-oxidanylideneazepan-1-yl)-2,3-dihydroindol-1-yl]carbonyl]pyrazole-3-carboxamide

Systemtic Name: 1-(3-cyano-4-fluoranyl-phenyl)-5-[[5-(2-oxidanylideneazepan-1-yl)-2,3-dihydroindol-1-yl]carbonyl]pyrazole-3-carboxamide Openeye Name: 1-(3-cyano-4-fluoro-phenyl)-5-[5-(2-oxoazepan-1-yl)indoline-1-carbonyl]pyrazole-3-carboxamide CAS Name: 1-(3-cyano-4-fluorophenyl)-5-[oxo-[5-(2-oxo-1-azepanyl)-2,3-dihydroindol-1-yl]methyl]-3-pyrazolecarboxamide IUPAC Name: 1-(3-cyano-4-fluorophenyl)-5-[5-(2-oxoazepan-1-yl)-2,3-dihydroindole-1-carbonyl]pyrazole-3-carboxamide Traditional Name: 1-(3-cyano-4-fluoro-phenyl)-5-[5-(2-ketoazepan-1-yl)indoline-1-carbonyl]pyrazole-3-carboxamide Formula: C26H23FN6O3 MolecularWeight: 486.497623

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)C2=CC3=C(C=C2)N(CC3)C(=O)C4=CC(=NN4C5=CC(=C(C=C5)F)C#N)C(=O)N

Isomeric SMILES

C1CCC(=O)N(CC1)C2=CC3=C(C=C2)N(CC3)C(=O)C4=CC(=NN4C5=CC(=C(C=C5)F)C#N)C(=O)N

InChI

InChI=1S/C26H23FN6O3/c27-20-7-5-19(13-17(20)15-28)33-23(14-21(30-33)25(29)35)26(36)32-11-9-16-12-18(6-8-22(16)32)31-10-3-1-2-4-24(31)34/h5-8,12-14H,1-4,9-11H2,(H2,29,35)