N-(1H-indol-5-yl)-N-[6-(4-methyl-3-oxidanyl-pent-1-ynyl)quinazolin-4-yl]benzenesulfonamide

Systemtic Name: N-(1H-indol-5-yl)-N-[6-(4-methyl-3-oxidanyl-pent-1-ynyl)quinazolin-4-yl]benzenesulfonamide Openeye Name: N-[6-(3-hydroxy-4-methyl-pent-1-ynyl)quinazolin-4-yl]-N-(1H-indol-5-yl)benzenesulfonamide CAS Name: N-[6-(3-hydroxy-4-methylpent-1-ynyl)-4-quinazolinyl]-N-(1H-indol-5-yl)benzenesulfonamide IUPAC Name: N-[6-(3-hydroxy-4-methylpent-1-ynyl)quinazolin-4-yl]-N-(1H-indol-5-yl)benzenesulfonamide Traditional Name: N-[6-(3-hydroxy-4-methyl-pent-1-ynyl)quinazolin-4-yl]-N-(1H-indol-5-yl)benzenesulfonamide Formula: C28H24N4O3S MolecularWeight: 496.58016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#CC1=CC2=C(C=C1)N=CN=C2N(C3=CC4=C(C=C3)NC=C4)S(=O)(=O)C5=CC=CC=C5)O

Isomeric SMILES

CC(C)C(C#CC1=CC2=C(C=C1)N=CN=C2N(C3=CC4=C(C=C3)NC=C4)S(=O)(=O)C5=CC=CC=C5)O

InChI

InChI=1S/C28H24N4O3S/c1-19(2)27(33)13-9-20-8-11-26-24(16-20)28(31-18-30-26)32(36(34,35)23-6-4-3-5-7-23)22-10-12-25-21(17-22)14-15-29-25/h3-8,10-12,14-19,27,29,33H,1-2H3