3-chloranyl-4-[(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-[(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[(3-allyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-3-chloro-benzonitrile CAS Name: 3-chloro-4-[[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]methyl]benzonitrile IUPAC Name: 3-chloro-4-[(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 4-[[(3-allyl-4-keto-quinazolin-2-yl)thio]methyl]-3-chloro-benzonitrile Formula: C19H14ClN3OS MolecularWeight: 367.85196

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(C=C(C=C3)C#N)Cl

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(C=C(C=C3)C#N)Cl

InChI

InChI=1S/C19H14ClN3OS/c1-2-9-23-18(24)15-5-3-4-6-17(15)22-19(23)25-12-14-8-7-13(11-21)10-16(14)20/h2-8,10H,1,9,12H2