N-(1H-indol-5-yl)-N-[6-[2-(4-oxidanyloxan-4-yl)ethynyl]quinazolin-4-yl]methanesulfonamide

Systemtic Name: N-(1H-indol-5-yl)-N-[6-[2-(4-oxidanyloxan-4-yl)ethynyl]quinazolin-4-yl]methanesulfonamide Openeye Name: N-[6-[2-(4-hydroxytetrahydropyran-4-yl)ethynyl]quinazolin-4-yl]-N-(1H-indol-5-yl)methanesulfonamide CAS Name: N-[6-[2-(4-hydroxy-4-oxanyl)ethynyl]-4-quinazolinyl]-N-(1H-indol-5-yl)methanesulfonamide IUPAC Name: N-[6-[2-(4-hydroxyoxan-4-yl)ethynyl]quinazolin-4-yl]-N-(1H-indol-5-yl)methanesulfonamide Traditional Name: N-[6-[2-(4-hydroxytetrahydropyran-4-yl)ethynyl]quinazolin-4-yl]-N-(1H-indol-5-yl)methanesulfonamide Formula: C24H22N4O4S MolecularWeight: 462.52088

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(C1=CC2=C(C=C1)NC=C2)C3=NC=NC4=C3C=C(C=C4)C#CC5(CCOCC5)O

Isomeric SMILES

CS(=O)(=O)N(C1=CC2=C(C=C1)NC=C2)C3=NC=NC4=C3C=C(C=C4)C#CC5(CCOCC5)O

InChI

InChI=1S/C24H22N4O4S/c1-33(30,31)28(19-3-5-21-18(15-19)7-11-25-21)23-20-14-17(2-4-22(20)26-16-27-23)6-8-24(29)9-12-32-13-10-24/h2-5,7,11,14-16,25,29H,9-10,12-13H2,1H3