2-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methylsulfanyl]-N-(2,6-dimethylphenyl)propanamide

Systemtic Name: 2-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methylsulfanyl]-N-(2,6-dimethylphenyl)propanamide Openeye Name: 2-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methylsulfanyl]-N-(2,6-dimethylphenyl)propanamide CAS Name: 2-[[2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methylthio]-N-(2,6-dimethylphenyl)propanamide IUPAC Name: 2-[[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-N-(2,6-dimethylphenyl)propanamide Traditional Name: 2-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methylthio]-N-(2,6-dimethylphenyl)propionamide Formula: C22H23BrN2O2S2 MolecularWeight: 491.46422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C(C)SCC2=CSC(=N2)C3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C(C)SCC2=CSC(=N2)C3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C22H23BrN2O2S2/c1-13-6-5-7-14(2)20(13)25-21(26)15(3)28-11-17-12-29-22(24-17)18-10-16(23)8-9-19(18)27-4/h5-10,12,15H,11H2,1-4H3,(H,25,26)