4-[[8-methoxy-6-(2-pyridin-3-ylethynyl)quinazolin-2-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[8-methoxy-6-(2-pyridin-3-ylethynyl)quinazolin-2-yl]amino]benzenesulfonamide Openeye Name: 4-[[8-methoxy-6-[2-(3-pyridyl)ethynyl]quinazolin-2-yl]amino]benzenesulfonamide CAS Name: 4-[[8-methoxy-6-[2-(3-pyridinyl)ethynyl]-2-quinazolinyl]amino]benzenesulfonamide IUPAC Name: 4-[[8-methoxy-6-(2-pyridin-3-ylethynyl)quinazolin-2-yl]amino]benzenesulfonamide Traditional Name: 4-[[8-methoxy-6-[2-(3-pyridyl)ethynyl]quinazolin-2-yl]amino]benzenesulfonamide Formula: C22H17N5O3S MolecularWeight: 431.46708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=CN=C(N=C12)NC3=CC=C(C=C3)S(=O)(=O)N)C#CC4=CN=CC=C4

Isomeric SMILES

COC1=CC(=CC2=CN=C(N=C12)NC3=CC=C(C=C3)S(=O)(=O)N)C#CC4=CN=CC=C4

InChI

InChI=1S/C22H17N5O3S/c1-30-20-12-16(5-4-15-3-2-10-24-13-15)11-17-14-25-22(27-21(17)20)26-18-6-8-19(9-7-18)31(23,28)29/h2-3,6-14H,1H3,(H2,23,28,29)(H,25,26,27)