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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O3S2/c1-4-6-15-9-11-16(12-10-15)19-14(2)27-21(22-19)23-20(24)17-7-5-8-18(13-17)28(3,25)26/h5,7-13H,4,6H2,1-3H3,(H,22,23,24)