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

Systemtic Name: 2-[(5-chloranylquinolin-8-yl)methylsulfanyl]-3-propan-2-yl-quinazolin-4-one Openeye Name: 2-[(5-chloro-8-quinolyl)methylsulfanyl]-3-isopropyl-quinazolin-4-one CAS Name: 2-[(5-chloro-8-quinolinyl)methylthio]-3-propan-2-yl-4-quinazolinone IUPAC Name: 2-[(5-chloroquinolin-8-yl)methylsulfanyl]-3-propan-2-ylquinazolin-4-one Traditional Name: 2-[(5-chloro-8-quinolyl)methylthio]-3-isopropyl-quinazolin-4-one Formula: C21H18ClN3OS MolecularWeight: 395.90512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC3=C4C(=C(C=C3)Cl)C=CC=N4

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC3=C4C(=C(C=C3)Cl)C=CC=N4

InChI

InChI=1S/C21H18ClN3OS/c1-13(2)25-20(26)16-6-3-4-8-18(16)24-21(25)27-12-14-9-10-17(22)15-7-5-11-23-19(14)15/h3-11,13H,12H2,1-2H3