ethyl 4-methyl-2-[4-(4-methylphenyl)sulfonylbutanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[4-(4-methylphenyl)sulfonylbutanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[4-(p-tolylsulfonyl)butanoylamino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[4-(4-methylphenyl)sulfonyl-1-oxobutyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[4-(4-methylphenyl)sulfonylbutanoylamino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-(4-tosylbutanoylamino)thiazole-5-carboxylic acid ethyl ester Formula: C18H22N2O5S2 MolecularWeight: 410.50768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CCCS(=O)(=O)C2=CC=C(C=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CCCS(=O)(=O)C2=CC=C(C=C2)C)C

InChI

InChI=1S/C18H22N2O5S2/c1-4-25-17(22)16-13(3)19-18(26-16)20-15(21)6-5-11-27(23,24)14-9-7-12(2)8-10-14/h7-10H,4-6,11H2,1-3H3,(H,19,20,21)