methyl 2-[[cyclohexyl-(2,4,6-trimethylphenyl)sulfonyl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[cyclohexyl-(2,4,6-trimethylphenyl)sulfonyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[cyclohexyl-(2,4,6-trimethylphenyl)sulfonyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[cyclohexyl-(2,4,6-trimethylphenyl)sulfonylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[cyclohexyl-(2,4,6-trimethylphenyl)sulfonylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[cyclohexyl(mesitylsulfonyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C21H28N2O4S2 MolecularWeight: 436.58802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(CC2=NC(=CS2)C(=O)OC)C3CCCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(CC2=NC(=CS2)C(=O)OC)C3CCCCC3)C

InChI

InChI=1S/C21H28N2O4S2/c1-14-10-15(2)20(16(3)11-14)29(25,26)23(17-8-6-5-7-9-17)12-19-22-18(13-28-19)21(24)27-4/h10-11,13,17H,5-9,12H2,1-4H3