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

Systemtic Name: 4-[7-chloranyl-3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylbutanenitrile Openeye Name: 4-[7-chloro-3-(o-tolyl)-4-oxo-quinazolin-2-yl]sulfanylbutanenitrile CAS Name: 4-[[7-chloro-3-(2-methylphenyl)-4-oxo-2-quinazolinyl]thio]butanenitrile IUPAC Name: 4-[7-chloro-3-(2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylbutanenitrile Traditional Name: 4-[[7-chloro-4-keto-3-(o-tolyl)quinazolin-2-yl]thio]butyronitrile Formula: C19H16ClN3OS MolecularWeight: 369.86784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCCCC#N

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCCCC#N

InChI

InChI=1S/C19H16ClN3OS/c1-13-6-2-3-7-17(13)23-18(24)15-9-8-14(20)12-16(15)22-19(23)25-11-5-4-10-21/h2-3,6-9,12H,4-5,11H2,1H3