N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-7-methoxy-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-7-methoxy-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-(2-chloro-5-morpholinosulfonyl-phenyl)-7-methoxy-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-7-methoxy-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-7-methoxy-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: (2-chloro-5-morpholinosulfonyl-phenyl)-[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amine Formula: C20H18ClF3N4O4S MolecularWeight: 502.89453

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NC(=N2)C(F)(F)F)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NC(=N2)C(F)(F)F)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

InChI

InChI=1S/C20H18ClF3N4O4S/c1-31-12-2-4-14-16(10-12)26-19(20(22,23)24)27-18(14)25-17-11-13(3-5-15(17)21)33(29,30)28-6-8-32-9-7-28/h2-5,10-11H,6-9H2,1H3,(H,25,26,27)