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

Systemtic Name: 4-[2-(3-cyanopropylsulfanyl)-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile Openeye Name: 4-[2-(3-cyanopropylsulfanyl)-4-oxo-quinazolin-3-yl]benzonitrile CAS Name: 4-[2-(3-cyanopropylthio)-4-oxo-3-quinazolinyl]benzonitrile IUPAC Name: 4-[2-(3-cyanopropylsulfanyl)-4-oxoquinazolin-3-yl]benzonitrile Traditional Name: 4-[2-(3-cyanopropylthio)-4-keto-quinazolin-3-yl]benzonitrile Formula: C19H14N4OS MolecularWeight: 346.40566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCCC#N)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCCC#N)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H14N4OS/c20-11-3-4-12-25-19-22-17-6-2-1-5-16(17)18(24)23(19)15-9-7-14(13-21)8-10-15/h1-2,5-10H,3-4,12H2