2-methyl-5-[(2-thiophen-2-ylquinazolin-4-yl)amino]isoindole-1,3-dione

Systemtic Name: 2-methyl-5-[(2-thiophen-2-ylquinazolin-4-yl)amino]isoindole-1,3-dione Openeye Name: 2-methyl-5-[[2-(2-thienyl)quinazolin-4-yl]amino]isoindoline-1,3-dione CAS Name: 2-methyl-5-[(2-thiophen-2-yl-4-quinazolinyl)amino]isoindole-1,3-dione IUPAC Name: 2-methyl-5-[(2-thiophen-2-ylquinazolin-4-yl)amino]isoindole-1,3-dione Traditional Name: 2-methyl-5-[[2-(2-thienyl)quinazolin-4-yl]amino]isoindoline-1,3-quinone Formula: C21H14N4O2S MolecularWeight: 386.42646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC3=NC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC3=NC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C21H14N4O2S/c1-25-20(26)13-9-8-12(11-15(13)21(25)27)22-18-14-5-2-3-6-16(14)23-19(24-18)17-7-4-10-28-17/h2-11H,1H3,(H,22,23,24)