4-(3,4-dimethoxyphenyl)-3-(furan-2-ylmethyl)-N-phenyl-1,3-thiazol-2-imine bromide

Systemtic Name: 4-(3,4-dimethoxyphenyl)-3-(furan-2-ylmethyl)-N-phenyl-1,3-thiazol-2-imine bromide Openeye Name: 4-(3,4-dimethoxyphenyl)-3-(2-furylmethyl)-N-phenyl-thiazol-2-imine bromide CAS Name: 4-(3,4-dimethoxyphenyl)-3-(2-furanylmethyl)-N-phenyl-2-thiazolimine bromide IUPAC Name: 4-(3,4-dimethoxyphenyl)-3-(furan-2-ylmethyl)-N-phenyl-1,3-thiazol-2-imine bromide Traditional Name: [4-(3,4-dimethoxyphenyl)-3-(2-furfuryl)-4-thiazolin-2-ylidene]-phenyl-amine bromide Formula: C22H20BrN2O3S- MolecularWeight: 472.3748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=NC3=CC=CC=C3)N2CC4=CC=CO4)OC.[Br-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=NC3=CC=CC=C3)N2CC4=CC=CO4)OC.[Br-]

InChI

InChI=1S/C22H20N2O3S.BrH/c1-25-20-11-10-16(13-21(20)26-2)19-15-28-22(23-17-7-4-3-5-8-17)24(19)14-18-9-6-12-27-18;/h3-13,15H,14H2,1-2H3;1H/p-1