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

Systemtic Name: N-(1H-indol-5-yl)-N-[6-[2-(1-oxidanylcyclohexyl)ethynyl]quinazolin-4-yl]benzenesulfonamide Openeye Name: N-[6-[2-(1-hydroxycyclohexyl)ethynyl]quinazolin-4-yl]-N-(1H-indol-5-yl)benzenesulfonamide CAS Name: N-[6-[2-(1-hydroxycyclohexyl)ethynyl]-4-quinazolinyl]-N-(1H-indol-5-yl)benzenesulfonamide IUPAC Name: N-[6-[2-(1-hydroxycyclohexyl)ethynyl]quinazolin-4-yl]-N-(1H-indol-5-yl)benzenesulfonamide Traditional Name: N-[6-[2-(1-hydroxycyclohexyl)ethynyl]quinazolin-4-yl]-N-(1H-indol-5-yl)benzenesulfonamide Formula: C30H26N4O3S MolecularWeight: 522.61744

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#CC2=CC3=C(C=C2)N=CN=C3N(C4=CC5=C(C=C4)NC=C5)S(=O)(=O)C6=CC=CC=C6)O

Isomeric SMILES

C1CCC(CC1)(C#CC2=CC3=C(C=C2)N=CN=C3N(C4=CC5=C(C=C4)NC=C5)S(=O)(=O)C6=CC=CC=C6)O

InChI

InChI=1S/C30H26N4O3S/c35-30(15-5-2-6-16-30)17-13-22-9-11-28-26(19-22)29(33-21-32-28)34(38(36,37)25-7-3-1-4-8-25)24-10-12-27-23(20-24)14-18-31-27/h1,3-4,7-12,14,18-21,31,35H,2,5-6,15-16H2