N-[1-azanyl-3-[(4-fluorophenyl)-pyridin-2-yl-amino]-1-oxidanylidene-propan-2-yl]-2-(2-azanylpyrimidin-4-yl)-1H-indole-5-carboxamide

Systemtic Name: N-[1-azanyl-3-[(4-fluorophenyl)-pyridin-2-yl-amino]-1-oxidanylidene-propan-2-yl]-2-(2-azanylpyrimidin-4-yl)-1H-indole-5-carboxamide Openeye Name: N-[2-amino-1-[[4-fluoro-N-(2-pyridyl)anilino]methyl]-2-oxo-ethyl]-2-(2-aminopyrimidin-4-yl)-1H-indole-5-carboxamide CAS Name: N-[1-amino-3-[4-fluoro-N-(2-pyridinyl)anilino]-1-oxopropan-2-yl]-2-(2-amino-4-pyrimidinyl)-1H-indole-5-carboxamide IUPAC Name: N-[1-amino-3-(4-fluoro-N-pyridin-2-ylanilino)-1-oxopropan-2-yl]-2-(2-aminopyrimidin-4-yl)-1H-indole-5-carboxamide Traditional Name: N-[2-amino-1-[[4-fluoro-N-(2-pyridyl)anilino]methyl]-2-keto-ethyl]-2-(2-aminopyrimidin-4-yl)-1H-indole-5-carboxamide Formula: C27H23FN8O2 MolecularWeight: 510.522323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)N(CC(C(=O)N)NC(=O)C2=CC3=C(C=C2)NC(=C3)C4=NC(=NC=C4)N)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=NC(=C1)N(CC(C(=O)N)NC(=O)C2=CC3=C(C=C2)NC(=C3)C4=NC(=NC=C4)N)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H23FN8O2/c28-18-5-7-19(8-6-18)36(24-3-1-2-11-31-24)15-23(25(29)37)34-26(38)16-4-9-20-17(13-16)14-22(33-20)21-10-12-32-27(30)35-21/h1-14,23,33H,15H2,(H2,29,37)(H,34,38)(H2,30,32,35)