4-[2-[(2-chloranylquinolin-3-yl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[(2-chloranylquinolin-3-yl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile Openeye Name: 4-[2-[(2-chloro-3-quinolyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]benzonitrile CAS Name: 4-[2-[(2-chloro-3-quinolinyl)methylthio]-4-oxo-3-quinazolinyl]benzonitrile IUPAC Name: 4-[2-[(2-chloroquinolin-3-yl)methylsulfanyl]-4-oxoquinazolin-3-yl]benzonitrile Traditional Name: 4-[2-[(2-chloro-3-quinolyl)methylthio]-4-keto-quinazolin-3-yl]benzonitrile Formula: C25H15ClN4OS MolecularWeight: 454.9308

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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)N3C5=CC=C(C=C5)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)Cl)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

InChI

InChI=1S/C25H15ClN4OS/c26-23-18(13-17-5-1-3-7-21(17)28-23)15-32-25-29-22-8-4-2-6-20(22)24(31)30(25)19-11-9-16(14-27)10-12-19/h1-13H,15H2