[5-[[5-fluoranyl-4-[(3-hydroxyphenyl)amino]pyrimidin-2-yl]amino]-1-benzofuran-2-yl]-piperazin-1-yl-methanone

Systemtic Name: [5-[[5-fluoranyl-4-[(3-hydroxyphenyl)amino]pyrimidin-2-yl]amino]-1-benzofuran-2-yl]-piperazin-1-yl-methanone Openeye Name: [5-[[5-fluoro-4-(3-hydroxyanilino)pyrimidin-2-yl]amino]benzofuran-2-yl]-piperazin-1-yl-methanone CAS Name: [5-[[5-fluoro-4-(3-hydroxyanilino)-2-pyrimidinyl]amino]-2-benzofuranyl]-(1-piperazinyl)methanone IUPAC Name: [5-[[5-fluoro-4-(3-hydroxyanilino)pyrimidin-2-yl]amino]-1-benzofuran-2-yl]-piperazin-1-ylmethanone Traditional Name: [5-[[5-fluoro-4-(3-hydroxyanilino)pyrimidin-2-yl]amino]benzofuran-2-yl]-piperazino-methanone Formula: C23H21FN6O3 MolecularWeight: 448.449643

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=CC3=C(O2)C=CC(=C3)NC4=NC=C(C(=N4)NC5=CC(=CC=C5)O)F

Isomeric SMILES

C1CN(CCN1)C(=O)C2=CC3=C(O2)C=CC(=C3)NC4=NC=C(C(=N4)NC5=CC(=CC=C5)O)F

InChI

InChI=1S/C23H21FN6O3/c24-18-13-26-23(29-21(18)27-15-2-1-3-17(31)12-15)28-16-4-5-19-14(10-16)11-20(33-19)22(32)30-8-6-25-7-9-30/h1-5,10-13,25,31H,6-9H2,(H2,26,27,28,29)