N-[3-bromanyl-4-[(3-fluorophenyl)methoxy]phenyl]-7-fluoranyl-6-[2-[[2-(1-methylimidazol-2-yl)sulfonylethylamino]methyl]-1,3-thiazol-4-yl]quinazolin-4-amine

Systemtic Name: N-[3-bromanyl-4-[(3-fluorophenyl)methoxy]phenyl]-7-fluoranyl-6-[2-[[2-(1-methylimidazol-2-yl)sulfonylethylamino]methyl]-1,3-thiazol-4-yl]quinazolin-4-amine Openeye Name: N-[3-bromo-4-[(3-fluorophenyl)methoxy]phenyl]-7-fluoro-6-[2-[[2-(1-methylimidazol-2-yl)sulfonylethylamino]methyl]thiazol-4-yl]quinazolin-4-amine CAS Name: N-[3-bromo-4-[(3-fluorophenyl)methoxy]phenyl]-7-fluoro-6-[2-[[2-[(1-methyl-2-imidazolyl)sulfonyl]ethylamino]methyl]-4-thiazolyl]-4-quinazolinamine IUPAC Name: N-[3-bromo-4-[(3-fluorophenyl)methoxy]phenyl]-7-fluoro-6-[2-[[2-(1-methylimidazol-2-yl)sulfonylethylamino]methyl]-1,3-thiazol-4-yl]quinazolin-4-amine Traditional Name: [4-[4-[3-bromo-4-(3-fluorobenzyl)oxy-anilino]-7-fluoro-quinazolin-6-yl]thiazol-2-yl]methyl-[2-(1-methylimidazol-2-yl)sulfonylethyl]amine Formula: C31H26BrF2N7O3S2 MolecularWeight: 726.614046

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1S(=O)(=O)CCNCC2=NC(=CS2)C3=C(C=C4C(=C3)C(=NC=N4)NC5=CC(=C(C=C5)OCC6=CC(=CC=C6)F)Br)F

Isomeric SMILES

CN1C=CN=C1S(=O)(=O)CCNCC2=NC(=CS2)C3=C(C=C4C(=C3)C(=NC=N4)NC5=CC(=C(C=C5)OCC6=CC(=CC=C6)F)Br)F

InChI

InChI=1S/C31H26BrF2N7O3S2/c1-41-9-7-36-31(41)46(42,43)10-8-35-15-29-40-27(17-45-29)22-13-23-26(14-25(22)34)37-18-38-30(23)39-21-5-6-28(24(32)12-21)44-16-19-3-2-4-20(33)11-19/h2-7,9,11-14,17-18,35H,8,10,15-16H2,1H3,(H,37,38,39)