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

Systemtic Name: N-[3-bromanyl-4-[(3-fluorophenyl)methoxy]phenyl]-6-[2-(2-ethylsulfonylethoxymethyl)-1,3-thiazol-4-yl]-7-fluoranyl-quinazolin-4-amine Openeye Name: N-[3-bromo-4-[(3-fluorophenyl)methoxy]phenyl]-6-[2-(2-ethylsulfonylethoxymethyl)thiazol-4-yl]-7-fluoro-quinazolin-4-amine CAS Name: N-[3-bromo-4-[(3-fluorophenyl)methoxy]phenyl]-6-[2-(2-ethylsulfonylethoxymethyl)-4-thiazolyl]-7-fluoro-4-quinazolinamine IUPAC Name: N-[3-bromo-4-[(3-fluorophenyl)methoxy]phenyl]-6-[2-(2-ethylsulfonylethoxymethyl)-1,3-thiazol-4-yl]-7-fluoroquinazolin-4-amine Traditional Name: [3-bromo-4-(3-fluorobenzyl)oxy-phenyl]-[6-[2-(2-esylethoxymethyl)thiazol-4-yl]-7-fluoro-quinazolin-4-yl]amine Formula: C29H25BrF2N4O4S2 MolecularWeight: 675.564006

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CCOCC1=NC(=CS1)C2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)Br)F

Isomeric SMILES

CCS(=O)(=O)CCOCC1=NC(=CS1)C2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)Br)F

InChI

InChI=1S/C29H25BrF2N4O4S2/c1-2-42(37,38)9-8-39-15-28-36-26(16-41-28)21-12-22-25(13-24(21)32)33-17-34-29(22)35-20-6-7-27(23(30)11-20)40-14-18-4-3-5-19(31)10-18/h3-7,10-13,16-17H,2,8-9,14-15H2,1H3,(H,33,34,35)