2-[2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanylethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanylethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[4-(cyclopropylamino)-2-quinazolinyl]thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[[4-(cyclopropylamino)quinazolin-2-yl]thio]ethyl]isoindoline-1,3-quinone Formula: C21H18N4O2S MolecularWeight: 390.45822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=NC3=CC=CC=C32)SCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CC1NC2=NC(=NC3=CC=CC=C32)SCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C21H18N4O2S/c26-19-14-5-1-2-6-15(14)20(27)25(19)11-12-28-21-23-17-8-4-3-7-16(17)18(24-21)22-13-9-10-13/h1-8,13H,9-12H2,(H,22,23,24)