ethyl 5-methyl-1-(4-methylphenyl)-4-[[4-(phenylsulfonyl)-5-thiophen-2-yl-1,2-oxazol-3-yl]carbonyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 5-methyl-1-(4-methylphenyl)-4-[[4-(phenylsulfonyl)-5-thiophen-2-yl-1,2-oxazol-3-yl]carbonyl]pyrazole-3-carboxylate Openeye Name: ethyl 4-[4-(benzenesulfonyl)-5-(2-thienyl)isoxazole-3-carbonyl]-5-methyl-1-(p-tolyl)pyrazole-3-carboxylate CAS Name: 4-[[4-(benzenesulfonyl)-5-thiophen-2-yl-3-isoxazolyl]-oxomethyl]-5-methyl-1-(4-methylphenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(benzenesulfonyl)-5-thiophen-2-yl-1,2-oxazole-3-carbonyl]-5-methyl-1-(4-methylphenyl)pyrazole-3-carboxylate Traditional Name: 4-[4-besyl-5-(2-thienyl)isoxazole-3-carbonyl]-5-methyl-1-(p-tolyl)pyrazole-3-carboxylic acid ethyl ester Formula: C28H23N3O6S2 MolecularWeight: 561.62872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1C(=O)C2=NOC(=C2S(=O)(=O)C3=CC=CC=C3)C4=CC=CS4)C)C5=CC=C(C=C5)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1C(=O)C2=NOC(=C2S(=O)(=O)C3=CC=CC=C3)C4=CC=CS4)C)C5=CC=C(C=C5)C

InChI

InChI=1S/C28H23N3O6S2/c1-4-36-28(33)23-22(18(3)31(29-23)19-14-12-17(2)13-15-19)25(32)24-27(26(37-30-24)21-11-8-16-38-21)39(34,35)20-9-6-5-7-10-20/h5-16H,4H2,1-3H3