N-(1H-indol-5-yl)-N-[6-(3-oxidanyl-3-pyrrolidin-2-yl-prop-1-ynyl)quinazolin-4-yl]benzenesulfonamide

Systemtic Name: N-(1H-indol-5-yl)-N-[6-(3-oxidanyl-3-pyrrolidin-2-yl-prop-1-ynyl)quinazolin-4-yl]benzenesulfonamide Openeye Name: N-[6-(3-hydroxy-3-pyrrolidin-2-yl-prop-1-ynyl)quinazolin-4-yl]-N-(1H-indol-5-yl)benzenesulfonamide CAS Name: N-[6-[3-hydroxy-3-(2-pyrrolidinyl)prop-1-ynyl]-4-quinazolinyl]-N-(1H-indol-5-yl)benzenesulfonamide IUPAC Name: N-[6-(3-hydroxy-3-pyrrolidin-2-ylprop-1-ynyl)quinazolin-4-yl]-N-(1H-indol-5-yl)benzenesulfonamide Traditional Name: N-[6-(3-hydroxy-3-pyrrolidin-2-yl-prop-1-ynyl)quinazolin-4-yl]-N-(1H-indol-5-yl)benzenesulfonamide Formula: C29H25N5O3S MolecularWeight: 523.6055

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(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

C1CC(NC1)C(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/C29H25N5O3S/c35-28(27-7-4-15-30-27)13-9-20-8-11-26-24(17-20)29(33-19-32-26)34(38(36,37)23-5-2-1-3-6-23)22-10-12-25-21(18-22)14-16-31-25/h1-3,5-6,8,10-12,14,16-19,27-28,30-31,35H,4,7,15H2