N-[3-ethynyl-4-[(3-fluorophenyl)methoxy]phenyl]-6-(1-methylsulfonylpiperidin-4-yl)oxy-quinazolin-4-amine

Systemtic Name: N-[3-ethynyl-4-[(3-fluorophenyl)methoxy]phenyl]-6-(1-methylsulfonylpiperidin-4-yl)oxy-quinazolin-4-amine Openeye Name: N-[3-ethynyl-4-[(3-fluorophenyl)methoxy]phenyl]-6-[(1-methylsulfonyl-4-piperidyl)oxy]quinazolin-4-amine CAS Name: N-[3-ethynyl-4-[(3-fluorophenyl)methoxy]phenyl]-6-[(1-methylsulfonyl-4-piperidinyl)oxy]-4-quinazolinamine IUPAC Name: N-[3-ethynyl-4-[(3-fluorophenyl)methoxy]phenyl]-6-(1-methylsulfonylpiperidin-4-yl)oxyquinazolin-4-amine Traditional Name: [3-ethynyl-4-(3-fluorobenzyl)oxy-phenyl]-[6-[(1-mesyl-4-piperidyl)oxy]quinazolin-4-yl]amine Formula: C29H27FN4O4S MolecularWeight: 546.612483

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)OC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)C#C

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)OC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)C#C

InChI

InChI=1S/C29H27FN4O4S/c1-3-21-16-23(7-10-28(21)37-18-20-5-4-6-22(30)15-20)33-29-26-17-25(8-9-27(26)31-19-32-29)38-24-11-13-34(14-12-24)39(2,35)36/h1,4-10,15-17,19,24H,11-14,18H2,2H3,(H,31,32,33)