4-[(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-2-(3,4-dimethoxyphenyl)-1,3-thiazole

Systemtic Name: 4-[(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-2-(3,4-dimethoxyphenyl)-1,3-thiazole Openeye Name: 4-[(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-2-(3,4-dimethoxyphenyl)thiazole CAS Name: 4-[[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]methyl]-2-(3,4-dimethoxyphenyl)thiazole IUPAC Name: 4-[(1-butyl-4,5-dimethylimidazol-2-yl)sulfanylmethyl]-2-(3,4-dimethoxyphenyl)-1,3-thiazole Traditional Name: 4-[[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]methyl]-2-(3,4-dimethoxyphenyl)thiazole Formula: C21H27N3O2S2 MolecularWeight: 417.58798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCC2=CSC(=N2)C3=CC(=C(C=C3)OC)OC)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SCC2=CSC(=N2)C3=CC(=C(C=C3)OC)OC)C)C

InChI

InChI=1S/C21H27N3O2S2/c1-6-7-10-24-15(3)14(2)22-21(24)28-13-17-12-27-20(23-17)16-8-9-18(25-4)19(11-16)26-5/h8-9,11-12H,6-7,10,13H2,1-5H3