2-(5-bromanyl-2,3-dihydroindol-1-yl)-4-[(4-fluorophenyl)methoxy]-N-(2-oxidanylideneazepan-3-yl)pyrimidine-5-carboxamide

Systemtic Name: 2-(5-bromanyl-2,3-dihydroindol-1-yl)-4-[(4-fluorophenyl)methoxy]-N-(2-oxidanylideneazepan-3-yl)pyrimidine-5-carboxamide Openeye Name: 2-(5-bromoindolin-1-yl)-4-[(4-fluorophenyl)methoxy]-N-(2-oxoazepan-3-yl)pyrimidine-5-carboxamide CAS Name: 2-(5-bromo-2,3-dihydroindol-1-yl)-4-[(4-fluorophenyl)methoxy]-N-(2-oxo-3-azepanyl)-5-pyrimidinecarboxamide IUPAC Name: 2-(5-bromo-2,3-dihydroindol-1-yl)-4-[(4-fluorophenyl)methoxy]-N-(2-oxoazepan-3-yl)pyrimidine-5-carboxamide Traditional Name: 2-(5-bromoindolin-1-yl)-4-(4-fluorobenzyl)oxy-N-(2-ketoazepan-3-yl)pyrimidine-5-carboxamide Formula: C26H25BrFN5O3 MolecularWeight: 554.410803

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)C2=CN=C(N=C2OCC3=CC=C(C=C3)F)N4CCC5=C4C=CC(=C5)Br

Isomeric SMILES

C1CCNC(=O)C(C1)NC(=O)C2=CN=C(N=C2OCC3=CC=C(C=C3)F)N4CCC5=C4C=CC(=C5)Br

InChI

InChI=1S/C26H25BrFN5O3/c27-18-6-9-22-17(13-18)10-12-33(22)26-30-14-20(23(34)31-21-3-1-2-11-29-24(21)35)25(32-26)36-15-16-4-7-19(28)8-5-16/h4-9,13-14,21H,1-3,10-12,15H2,(H,29,35)(H,31,34)