2-[(2-chloranylquinolin-3-yl)methylsulfanyl]-3-(pyridin-3-ylmethyl)quinazolin-4-one

Systemtic Name: 2-[(2-chloranylquinolin-3-yl)methylsulfanyl]-3-(pyridin-3-ylmethyl)quinazolin-4-one Openeye Name: 2-[(2-chloro-3-quinolyl)methylsulfanyl]-3-(3-pyridylmethyl)quinazolin-4-one CAS Name: 2-[(2-chloro-3-quinolinyl)methylthio]-3-(3-pyridinylmethyl)-4-quinazolinone IUPAC Name: 2-[(2-chloroquinolin-3-yl)methylsulfanyl]-3-(pyridin-3-ylmethyl)quinazolin-4-one Traditional Name: 2-[(2-chloro-3-quinolyl)methylthio]-3-(3-pyridylmethyl)quinazolin-4-one Formula: C24H17ClN4OS MolecularWeight: 444.93598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)Cl)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CN=CC=C5

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)Cl)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CN=CC=C5

InChI

InChI=1S/C24H17ClN4OS/c25-22-18(12-17-7-1-3-9-20(17)27-22)15-31-24-28-21-10-4-2-8-19(21)23(30)29(24)14-16-6-5-11-26-13-16/h1-13H,14-15H2