N-[7-bromanyl-4-[(3-chloranyl-4-fluoranyl-phenyl)amino]quinazolin-6-yl]-3-(phenylsulfonyl)propanamide

Systemtic Name: N-[7-bromanyl-4-[(3-chloranyl-4-fluoranyl-phenyl)amino]quinazolin-6-yl]-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-[7-bromo-4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]propanamide CAS Name: 3-(benzenesulfonyl)-N-[7-bromo-4-(3-chloro-4-fluoroanilino)-6-quinazolinyl]propanamide IUPAC Name: 3-(benzenesulfonyl)-N-[7-bromo-4-(3-chloro-4-fluoroanilino)quinazolin-6-yl]propanamide Traditional Name: 3-besyl-N-[7-bromo-4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]propionamide Formula: C23H17BrClFN4O3S MolecularWeight: 563.826483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)Br

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)Br

InChI

InChI=1S/C23H17BrClFN4O3S/c24-17-12-20-16(23(28-13-27-20)29-14-6-7-19(26)18(25)10-14)11-21(17)30-22(31)8-9-34(32,33)15-4-2-1-3-5-15/h1-7,10-13H,8-9H2,(H,30,31)(H,27,28,29)