4-[2-(2-chloranylprop-2-enylsulfanyl)-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile

Systemtic Name: 4-[2-(2-chloranylprop-2-enylsulfanyl)-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile Openeye Name: 4-[2-(2-chloroallylsulfanyl)-4-oxo-quinazolin-3-yl]benzonitrile CAS Name: 4-[2-(2-chloroprop-2-enylthio)-4-oxo-3-quinazolinyl]benzonitrile IUPAC Name: 4-[2-(2-chloroprop-2-enylsulfanyl)-4-oxoquinazolin-3-yl]benzonitrile Traditional Name: 4-[2-(2-chloroallylthio)-4-keto-quinazolin-3-yl]benzonitrile Formula: C18H12ClN3OS MolecularWeight: 353.82538

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C#N)Cl

Isomeric SMILES

C=C(CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C#N)Cl

InChI

InChI=1S/C18H12ClN3OS/c1-12(19)11-24-18-21-16-5-3-2-4-15(16)17(23)22(18)14-8-6-13(10-20)7-9-14/h2-9H,1,11H2