N-(3-chloranyl-2-fluoranyl-phenyl)-7-methoxy-6-[(3R)-1-methylsulfonylpyrrolidin-3-yl]oxy-quinazolin-4-amine

Systemtic Name: N-(3-chloranyl-2-fluoranyl-phenyl)-7-methoxy-6-[(3R)-1-methylsulfonylpyrrolidin-3-yl]oxy-quinazolin-4-amine Openeye Name: N-(3-chloro-2-fluoro-phenyl)-7-methoxy-6-[(3R)-1-methylsulfonylpyrrolidin-3-yl]oxy-quinazolin-4-amine CAS Name: N-(3-chloro-2-fluorophenyl)-7-methoxy-6-[[(3R)-1-methylsulfonyl-3-pyrrolidinyl]oxy]-4-quinazolinamine IUPAC Name: N-(3-chloro-2-fluorophenyl)-7-methoxy-6-[(3R)-1-methylsulfonylpyrrolidin-3-yl]oxyquinazolin-4-amine Traditional Name: (3-chloro-2-fluoro-phenyl)-[6-[(3R)-1-mesylpyrrolidin-3-yl]oxy-7-methoxy-quinazolin-4-yl]amine Formula: C20H20ClFN4O4S MolecularWeight: 466.913603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=C(C(=CC=C3)Cl)F)OC4CCN(C4)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=C(C(=CC=C3)Cl)F)O[C@@H]4CCN(C4)S(=O)(=O)C

InChI

InChI=1S/C20H20ClFN4O4S/c1-29-17-9-16-13(8-18(17)30-12-6-7-26(10-12)31(2,27)28)20(24-11-23-16)25-15-5-3-4-14(21)19(15)22/h3-5,8-9,11-12H,6-7,10H2,1-2H3,(H,23,24,25)/t12-/m1/s1