2-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]methylsulfanyl]-N-(2,6-dimethylphenyl)propanamide

Systemtic Name: 2-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]methylsulfanyl]-N-(2,6-dimethylphenyl)propanamide Openeye Name: 2-[[2-(3-bromophenyl)thiazol-4-yl]methylsulfanyl]-N-(2,6-dimethylphenyl)propanamide CAS Name: 2-[[2-(3-bromophenyl)-4-thiazolyl]methylthio]-N-(2,6-dimethylphenyl)propanamide IUPAC Name: 2-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]methylsulfanyl]-N-(2,6-dimethylphenyl)propanamide Traditional Name: 2-[[2-(3-bromophenyl)thiazol-4-yl]methylthio]-N-(2,6-dimethylphenyl)propionamide Formula: C21H21BrN2OS2 MolecularWeight: 461.43824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21BrN2OS2/c1-13-6-4-7-14(2)19(13)24-20(25)15(3)26-11-18-12-27-21(23-18)16-8-5-9-17(22)10-16/h4-10,12,15H,11H2,1-3H3,(H,24,25)