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

Systemtic Name: N-[3-chloranyl-4-[(3-fluorophenyl)methoxy]phenyl]-7-fluoranyl-6-[2-[1-(2-propylsulfonylethylamino)ethyl]-1,3-thiazol-4-yl]quinazolin-4-amine Openeye Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-7-fluoro-6-[2-[1-(2-propylsulfonylethylamino)ethyl]thiazol-4-yl]quinazolin-4-amine CAS Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-7-fluoro-6-[2-[1-(2-propylsulfonylethylamino)ethyl]-4-thiazolyl]-4-quinazolinamine IUPAC Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-7-fluoro-6-[2-[1-(2-propylsulfonylethylamino)ethyl]-1,3-thiazol-4-yl]quinazolin-4-amine Traditional Name: 1-[4-[4-[3-chloro-4-(3-fluorobenzyl)oxy-anilino]-7-fluoro-quinazolin-6-yl]thiazol-2-yl]ethyl-(2-propylsulfonylethyl)amine Formula: C31H30ClF2N5O3S2 MolecularWeight: 658.181406

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)CCNC(C)C1=NC(=CS1)C2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)Cl)F

Isomeric SMILES

CCCS(=O)(=O)CCNC(C)C1=NC(=CS1)C2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)Cl)F

InChI

InChI=1S/C31H30ClF2N5O3S2/c1-3-10-44(40,41)11-9-35-19(2)31-39-28(17-43-31)23-14-24-27(15-26(23)34)36-18-37-30(24)38-22-7-8-29(25(32)13-22)42-16-20-5-4-6-21(33)12-20/h4-8,12-15,17-19,35H,3,9-11,16H2,1-2H3,(H,36,37,38)