4-[7-chloranyl-3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylbutanenitrile

Systemtic Name: 4-[7-chloranyl-3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylbutanenitrile Openeye Name: 4-[7-chloro-3-(4-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanylbutanenitrile CAS Name: 4-[[7-chloro-3-(4-chlorophenyl)-4-oxo-2-quinazolinyl]thio]butanenitrile IUPAC Name: 4-[7-chloro-3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylbutanenitrile Traditional Name: 4-[[7-chloro-3-(4-chlorophenyl)-4-keto-quinazolin-2-yl]thio]butyronitrile Formula: C18H13Cl2N3OS MolecularWeight: 390.28632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCCCC#N)Cl

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCCCC#N)Cl

InChI

InChI=1S/C18H13Cl2N3OS/c19-12-3-6-14(7-4-12)23-17(24)15-8-5-13(20)11-16(15)22-18(23)25-10-2-1-9-21/h3-8,11H,1-2,10H2