N-[5-methyl-4-(4-propylphenyl)-1,3-thiazol-2-yl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[5-methyl-4-(4-propylphenyl)-1,3-thiazol-2-yl]-4-methylsulfonyl-benzamide Openeye Name: N-[5-methyl-4-(4-propylphenyl)thiazol-2-yl]-4-methylsulfonyl-benzamide CAS Name: N-[5-methyl-4-(4-propylphenyl)-2-thiazolyl]-4-methylsulfonylbenzamide IUPAC Name: N-[5-methyl-4-(4-propylphenyl)-1,3-thiazol-2-yl]-4-methylsulfonylbenzamide Traditional Name: 4-mesyl-N-[5-methyl-4-(4-propylphenyl)thiazol-2-yl]benzamide Formula: C21H22N2O3S2 MolecularWeight: 414.54098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C)C

InChI

InChI=1S/C21H22N2O3S2/c1-4-5-15-6-8-16(9-7-15)19-14(2)27-21(22-19)23-20(24)17-10-12-18(13-11-17)28(3,25)26/h6-13H,4-5H2,1-3H3,(H,22,23,24)