N-(3-chloranyl-4-phenoxy-phenyl)-6-[2-(4-methylsulfonylmorpholin-2-yl)ethynyl]quinazolin-4-amine

Systemtic Name: N-(3-chloranyl-4-phenoxy-phenyl)-6-[2-(4-methylsulfonylmorpholin-2-yl)ethynyl]quinazolin-4-amine Openeye Name: N-(3-chloro-4-phenoxy-phenyl)-6-[2-(4-methylsulfonylmorpholin-2-yl)ethynyl]quinazolin-4-amine CAS Name: N-(3-chloro-4-phenoxyphenyl)-6-[2-(4-methylsulfonyl-2-morpholinyl)ethynyl]-4-quinazolinamine IUPAC Name: N-(3-chloro-4-phenoxyphenyl)-6-[2-(4-methylsulfonylmorpholin-2-yl)ethynyl]quinazolin-4-amine Traditional Name: (3-chloro-4-phenoxy-phenyl)-[6-[2-(4-mesylmorpholin-2-yl)ethynyl]quinazolin-4-yl]amine Formula: C27H23ClN4O4S MolecularWeight: 535.01392

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCOC(C1)C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OC5=CC=CC=C5)Cl

Isomeric SMILES

CS(=O)(=O)N1CCOC(C1)C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OC5=CC=CC=C5)Cl

InChI

InChI=1S/C27H23ClN4O4S/c1-37(33,34)32-13-14-35-22(17-32)10-7-19-8-11-25-23(15-19)27(30-18-29-25)31-20-9-12-26(24(28)16-20)36-21-5-3-2-4-6-21/h2-6,8-9,11-12,15-16,18,22H,13-14,17H2,1H3,(H,29,30,31)