N-(3-chloranyl-2-fluoranyl-phenyl)-6-methoxy-7-(1-methylsulfonylpiperidin-4-yl)oxy-quinazolin-4-amine

Systemtic Name: N-(3-chloranyl-2-fluoranyl-phenyl)-6-methoxy-7-(1-methylsulfonylpiperidin-4-yl)oxy-quinazolin-4-amine Openeye Name: N-(3-chloro-2-fluoro-phenyl)-6-methoxy-7-[(1-methylsulfonyl-4-piperidyl)oxy]quinazolin-4-amine CAS Name: N-(3-chloro-2-fluorophenyl)-6-methoxy-7-[(1-methylsulfonyl-4-piperidinyl)oxy]-4-quinazolinamine IUPAC Name: N-(3-chloro-2-fluorophenyl)-6-methoxy-7-(1-methylsulfonylpiperidin-4-yl)oxyquinazolin-4-amine Traditional Name: (3-chloro-2-fluoro-phenyl)-[7-[(1-mesyl-4-piperidyl)oxy]-6-methoxy-quinazolin-4-yl]amine Formula: C21H22ClFN4O4S MolecularWeight: 480.940183

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C(=CC=C3)Cl)F)OC4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C(=CC=C3)Cl)F)OC4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C21H22ClFN4O4S/c1-30-18-10-14-17(11-19(18)31-13-6-8-27(9-7-13)32(2,28)29)24-12-25-21(14)26-16-5-3-4-15(22)20(16)23/h3-5,10-13H,6-9H2,1-2H3,(H,24,25,26)