4-[2-[2-(3-chloranylphenoxy)ethylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[2-(3-chloranylphenoxy)ethylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile Openeye Name: 4-[2-[2-(3-chlorophenoxy)ethylsulfanyl]-4-oxo-quinazolin-3-yl]benzonitrile CAS Name: 4-[2-[2-(3-chlorophenoxy)ethylthio]-4-oxo-3-quinazolinyl]benzonitrile IUPAC Name: 4-[2-[2-(3-chlorophenoxy)ethylsulfanyl]-4-oxoquinazolin-3-yl]benzonitrile Traditional Name: 4-[2-[2-(3-chlorophenoxy)ethylthio]-4-keto-quinazolin-3-yl]benzonitrile Formula: C23H16ClN3O2S MolecularWeight: 433.91004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCOC3=CC(=CC=C3)Cl)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCOC3=CC(=CC=C3)Cl)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H16ClN3O2S/c24-17-4-3-5-19(14-17)29-12-13-30-23-26-21-7-2-1-6-20(21)22(28)27(23)18-10-8-16(15-25)9-11-18/h1-11,14H,12-13H2