4-[2-[4-[1H-indol-5-yl-(phenylmethyl)amino]quinazolin-6-yl]ethynyl]oxan-4-ol

Systemtic Name: 4-[2-[4-[1H-indol-5-yl-(phenylmethyl)amino]quinazolin-6-yl]ethynyl]oxan-4-ol Openeye Name: 4-[2-[4-[benzyl(1H-indol-5-yl)amino]quinazolin-6-yl]ethynyl]tetrahydropyran-4-ol CAS Name: 4-[2-[4-[1H-indol-5-yl-(phenylmethyl)amino]-6-quinazolinyl]ethynyl]-4-oxanol IUPAC Name: 4-[2-[4-[benzyl(1H-indol-5-yl)amino]quinazolin-6-yl]ethynyl]oxan-4-ol Traditional Name: 4-[2-[4-[benzyl(1H-indol-5-yl)amino]quinazolin-6-yl]ethynyl]tetrahydropyran-4-ol Formula: C30H26N4O2 MolecularWeight: 474.55304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C#CC2=CC3=C(C=C2)N=CN=C3N(CC4=CC=CC=C4)C5=CC6=C(C=C5)NC=C6)O

Isomeric SMILES

C1COCCC1(C#CC2=CC3=C(C=C2)N=CN=C3N(CC4=CC=CC=C4)C5=CC6=C(C=C5)NC=C6)O

InChI

InChI=1S/C30H26N4O2/c35-30(13-16-36-17-14-30)12-10-22-6-8-28-26(18-22)29(33-21-32-28)34(20-23-4-2-1-3-5-23)25-7-9-27-24(19-25)11-15-31-27/h1-9,11,15,18-19,21,31,35H,13-14,16-17,20H2