3-[(2-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylsulfanyl]-6,7-dimethoxy-quinazolin-4-imine

Systemtic Name: 3-[(2-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylsulfanyl]-6,7-dimethoxy-quinazolin-4-imine Openeye Name: 3-[(2-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylsulfanyl]-6,7-dimethoxy-quinazolin-4-imine CAS Name: 3-[(2-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylthio]-6,7-dimethoxy-4-quinazolinimine IUPAC Name: 3-[(2-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylsulfanyl]-6,7-dimethoxyquinazolin-4-imine Traditional Name: [3-(2-chlorobenzyl)-2-[(2-fluorobenzyl)thio]-6,7-dimethoxy-quinazolin-4-ylidene]amine Formula: C24H21ClFN3O2S MolecularWeight: 469.958843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=N)N(C(=N2)SCC3=CC=CC=C3F)CC4=CC=CC=C4Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=N)N(C(=N2)SCC3=CC=CC=C3F)CC4=CC=CC=C4Cl)OC

InChI

InChI=1S/C24H21ClFN3O2S/c1-30-21-11-17-20(12-22(21)31-2)28-24(32-14-16-8-4-6-10-19(16)26)29(23(17)27)13-15-7-3-5-9-18(15)25/h3-12,27H,13-14H2,1-2H3