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

Systemtic Name: ethyl 2-[3-(4-methylphenyl)sulfonylpropanoylamino]-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-phenyl-2-[3-(p-tolylsulfonyl)propanoylamino]thiazole-5-carboxylate CAS Name: 2-[[3-(4-methylphenyl)sulfonyl-1-oxopropyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-methylphenyl)sulfonylpropanoylamino]-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 4-phenyl-2-(3-tosylpropanoylamino)thiazole-5-carboxylic acid ethyl ester Formula: C22H22N2O5S2 MolecularWeight: 458.55048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O5S2/c1-3-29-21(26)20-19(16-7-5-4-6-8-16)24-22(30-20)23-18(25)13-14-31(27,28)17-11-9-15(2)10-12-17/h4-12H,3,13-14H2,1-2H3,(H,23,24,25)