6,7-dimethoxy-3-(3-methoxypropyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-imine

Systemtic Name: 6,7-dimethoxy-3-(3-methoxypropyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-imine Openeye Name: 6,7-dimethoxy-3-(3-methoxypropyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-imine CAS Name: 6,7-dimethoxy-3-(3-methoxypropyl)-2-[[3-(trifluoromethyl)phenyl]methylthio]-4-quinazolinimine IUPAC Name: 6,7-dimethoxy-3-(3-methoxypropyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-imine Traditional Name: [6,7-dimethoxy-3-(3-methoxypropyl)-2-[[3-(trifluoromethyl)benzyl]thio]quinazolin-4-ylidene]amine Formula: C22H24F3N3O3S MolecularWeight: 467.50447

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=N)C2=CC(=C(C=C2N=C1SCC3=CC(=CC=C3)C(F)(F)F)OC)OC

Isomeric SMILES

COCCCN1C(=N)C2=CC(=C(C=C2N=C1SCC3=CC(=CC=C3)C(F)(F)F)OC)OC

InChI

InChI=1S/C22H24F3N3O3S/c1-29-9-5-8-28-20(26)16-11-18(30-2)19(31-3)12-17(16)27-21(28)32-13-14-6-4-7-15(10-14)22(23,24)25/h4,6-7,10-12,26H,5,8-9,13H2,1-3H3