ethyl 2-[2-[4-(4-tert-butylphenyl)-4-oxidanylidene-butanoyl]oxyethanoylamino]-5-chloranyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[4-(4-tert-butylphenyl)-4-oxidanylidene-butanoyl]oxyethanoylamino]-5-chloranyl-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-(4-tert-butylphenyl)-4-oxo-butanoyl]oxyacetyl]amino]-5-chloro-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[4-(4-tert-butylphenyl)-1,4-dioxobutoxy]-1-oxoethyl]amino]-5-chloro-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(4-tert-butylphenyl)-4-oxobutanoyl]oxyacetyl]amino]-5-chloro-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[4-(4-tert-butylphenyl)-4-keto-butanoyl]oxyacetyl]amino]-5-chloro-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C29H30ClNO6S MolecularWeight: 556.0696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)Cl)NC(=O)COC(=O)CCC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)Cl)NC(=O)COC(=O)CCC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C29H30ClNO6S/c1-5-36-28(35)25-24(19-9-7-6-8-10-19)26(30)38-27(25)31-22(33)17-37-23(34)16-15-21(32)18-11-13-20(14-12-18)29(2,3)4/h6-14H,5,15-17H2,1-4H3,(H,31,33)