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

Systemtic Name: 3-[(2-chlorophenyl)methyl]-6,7-dimethoxy-2-phenethylsulfanyl-quinazolin-4-imine Openeye Name: 3-[(2-chlorophenyl)methyl]-6,7-dimethoxy-2-phenethylsulfanyl-quinazolin-4-imine CAS Name: 3-[(2-chlorophenyl)methyl]-6,7-dimethoxy-2-(phenethylthio)-4-quinazolinimine IUPAC Name: 3-[(2-chlorophenyl)methyl]-6,7-dimethoxy-2-phenethylsulfanylquinazolin-4-imine Traditional Name: [3-(2-chlorobenzyl)-6,7-dimethoxy-2-(phenethylthio)quinazolin-4-ylidene]amine Formula: C25H24ClN3O2S MolecularWeight: 465.99496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=N)N(C(=N2)SCCC3=CC=CC=C3)CC4=CC=CC=C4Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=N)N(C(=N2)SCCC3=CC=CC=C3)CC4=CC=CC=C4Cl)OC

InChI

InChI=1S/C25H24ClN3O2S/c1-30-22-14-19-21(15-23(22)31-2)28-25(32-13-12-17-8-4-3-5-9-17)29(24(19)27)16-18-10-6-7-11-20(18)26/h3-11,14-15,27H,12-13,16H2,1-2H3