3-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanenitrile

Systemtic Name: 3-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanenitrile Openeye Name: 3-[3-(3-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanylpropanenitrile CAS Name: 3-[[3-(3-chlorophenyl)-4-oxo-2-quinazolinyl]thio]propanenitrile IUPAC Name: 3-[3-(3-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylpropanenitrile Traditional Name: 3-[[3-(3-chlorophenyl)-4-keto-quinazolin-2-yl]thio]propionitrile Formula: C17H12ClN3OS MolecularWeight: 341.81468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12ClN3OS/c18-12-5-3-6-13(11-12)21-16(22)14-7-1-2-8-15(14)20-17(21)23-10-4-9-19/h1-3,5-8,11H,4,10H2