3-[3-[2,4-bis(fluoranyl)phenyl]-6-chloranyl-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanenitrile

Systemtic Name: 3-[3-[2,4-bis(fluoranyl)phenyl]-6-chloranyl-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanenitrile Openeye Name: 3-[6-chloro-3-(2,4-difluorophenyl)-4-oxo-quinazolin-2-yl]sulfanylpropanenitrile CAS Name: 3-[[6-chloro-3-(2,4-difluorophenyl)-4-oxo-2-quinazolinyl]thio]propanenitrile IUPAC Name: 3-[6-chloro-3-(2,4-difluorophenyl)-4-oxoquinazolin-2-yl]sulfanylpropanenitrile Traditional Name: 3-[[6-chloro-3-(2,4-difluorophenyl)-4-keto-quinazolin-2-yl]thio]propionitrile Formula: C17H10ClF2N3OS MolecularWeight: 377.795606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)F)N2C(=O)C3=C(C=CC(=C3)Cl)N=C2SCCC#N

Isomeric SMILES

C1=CC(=C(C=C1F)F)N2C(=O)C3=C(C=CC(=C3)Cl)N=C2SCCC#N

InChI

InChI=1S/C17H10ClF2N3OS/c18-10-2-4-14-12(8-10)16(24)23(17(22-14)25-7-1-6-21)15-5-3-11(19)9-13(15)20/h2-5,8-9H,1,7H2