2-[3-[4-[[1-[2-[[2,3-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl]pyrazol-4-yl]amino]-5-propan-2-yloxy-quinazolin-7-yl]oxypropylamino]ethyl dihydrogen phosphate

Systemtic Name: 2-[3-[4-[[1-[2-[[2,3-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl]pyrazol-4-yl]amino]-5-propan-2-yloxy-quinazolin-7-yl]oxypropylamino]ethyl dihydrogen phosphate Openeye Name: 2-[3-[4-[[1-[2-(2,3-difluoroanilino)-2-oxo-ethyl]pyrazol-4-yl]amino]-5-isopropoxy-quinazolin-7-yl]oxypropylamino]ethyl dihydrogen phosphate CAS Name: 2-[3-[[4-[[1-[2-(2,3-difluoroanilino)-2-oxoethyl]-4-pyrazolyl]amino]-5-propan-2-yloxy-7-quinazolinyl]oxy]propylamino]ethyl dihydrogen phosphate IUPAC Name: 2-[3-[4-[[1-[2-(2,3-difluoroanilino)-2-oxoethyl]pyrazol-4-yl]amino]-5-propan-2-yloxyquinazolin-7-yl]oxypropylamino]ethyl dihydrogen phosphate Traditional Name: 2-[3-[4-[[1-[2-(2,3-difluoroanilino)-2-keto-ethyl]pyrazol-4-yl]amino]-5-isopropoxy-quinazolin-7-yl]oxypropylamino]ethyl dihydrogen phosphate Formula: C27H32F2N7O7P MolecularWeight: 635.556247

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C2C(=CC(=C1)OCCCNCCOP(=O)(O)O)N=CN=C2NC3=CN(N=C3)CC(=O)NC4=C(C(=CC=C4)F)F

Isomeric SMILES

CC(C)OC1=C2C(=CC(=C1)OCCCNCCOP(=O)(O)O)N=CN=C2NC3=CN(N=C3)CC(=O)NC4=C(C(=CC=C4)F)F

InChI

InChI=1S/C27H32F2N7O7P/c1-17(2)43-23-12-19(41-9-4-7-30-8-10-42-44(38,39)40)11-22-25(23)27(32-16-31-22)34-18-13-33-36(14-18)15-24(37)35-21-6-3-5-20(28)26(21)29/h3,5-6,11-14,16-17,30H,4,7-10,15H2,1-2H3,(H,35,37)(H,31,32,34)(H2,38,39,40)