7-chloranyl-3-prop-2-enyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-3-prop-2-enyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-one Openeye Name: 3-allyl-7-chloro-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-3-prop-2-enyl-2-[[3-(trifluoromethyl)phenyl]methylthio]-4-quinazolinone IUPAC Name: 7-chloro-3-prop-2-enyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-allyl-7-chloro-2-[[3-(trifluoromethyl)benzyl]thio]quinazolin-4-one Formula: C19H14ClF3N2OS MolecularWeight: 410.84047

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H14ClF3N2OS/c1-2-8-25-17(26)15-7-6-14(20)10-16(15)24-18(25)27-11-12-4-3-5-13(9-12)19(21,22)23/h2-7,9-10H,1,8,11H2