2-[(5-chloranylquinolin-8-yl)methylsulfanyl]-3-(3-morpholin-4-ylpropyl)quinazolin-4-one

Systemtic Name: 2-[(5-chloranylquinolin-8-yl)methylsulfanyl]-3-(3-morpholin-4-ylpropyl)quinazolin-4-one Openeye Name: 2-[(5-chloro-8-quinolyl)methylsulfanyl]-3-(3-morpholinopropyl)quinazolin-4-one CAS Name: 2-[(5-chloro-8-quinolinyl)methylthio]-3-[3-(4-morpholinyl)propyl]-4-quinazolinone IUPAC Name: 2-[(5-chloroquinolin-8-yl)methylsulfanyl]-3-(3-morpholin-4-ylpropyl)quinazolin-4-one Traditional Name: 2-[(5-chloro-8-quinolyl)methylthio]-3-(3-morpholinopropyl)quinazolin-4-one Formula: C25H25ClN4O2S MolecularWeight: 481.0096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN2C(=O)C3=CC=CC=C3N=C2SCC4=C5C(=C(C=C4)Cl)C=CC=N5

Isomeric SMILES

C1COCCN1CCCN2C(=O)C3=CC=CC=C3N=C2SCC4=C5C(=C(C=C4)Cl)C=CC=N5

InChI

InChI=1S/C25H25ClN4O2S/c26-21-9-8-18(23-19(21)6-3-10-27-23)17-33-25-28-22-7-2-1-5-20(22)24(31)30(25)12-4-11-29-13-15-32-16-14-29/h1-3,5-10H,4,11-17H2