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

Systemtic Name: ethyl 2-[3-(4-methylphenyl)sulfonylpropanoylamino]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[3-(p-tolylsulfonyl)propanoylamino]thiazole-4-carboxylate CAS Name: 2-[[3-(4-methylphenyl)sulfonyl-1-oxopropyl]amino]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-methylphenyl)sulfonylpropanoylamino]-1,3-thiazole-4-carboxylate Traditional Name: 2-(3-tosylpropanoylamino)thiazole-4-carboxylic acid ethyl ester Formula: C16H18N2O5S2 MolecularWeight: 382.45452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)NC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)NC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H18N2O5S2/c1-3-23-15(20)13-10-24-16(17-13)18-14(19)8-9-25(21,22)12-6-4-11(2)5-7-12/h4-7,10H,3,8-9H2,1-2H3,(H,17,18,19)