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

Systemtic Name: ethyl 4-methyl-2-[3-(4-methylphenyl)sulfonylpropanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[3-(p-tolylsulfonyl)propanoylamino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[3-(4-methylphenyl)sulfonyl-1-oxopropyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[3-(4-methylphenyl)sulfonylpropanoylamino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-(3-tosylpropanoylamino)thiazole-5-carboxylic acid ethyl ester Formula: C17H20N2O5S2 MolecularWeight: 396.4811

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O5S2/c1-4-24-16(21)15-12(3)18-17(25-15)19-14(20)9-10-26(22,23)13-7-5-11(2)6-8-13/h5-8H,4,9-10H2,1-3H3,(H,18,19,20)