methyl 4-tert-butyl-5-chloranyl-2-[2-(3-phenoxyphenyl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-tert-butyl-5-chloranyl-2-[2-(3-phenoxyphenyl)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-tert-butyl-5-chloro-2-[[2-(3-phenoxyphenyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-tert-butyl-5-chloro-2-[[1-oxo-2-(3-phenoxyphenyl)ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-tert-butyl-5-chloro-2-[[2-(3-phenoxyphenyl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-tert-butyl-5-chloro-2-[[2-(3-phenoxyphenyl)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C24H24ClNO4S MolecularWeight: 457.96966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(SC(=C1C(=O)OC)NC(=O)CC2=CC(=CC=C2)OC3=CC=CC=C3)Cl

Isomeric SMILES

CC(C)(C)C1=C(SC(=C1C(=O)OC)NC(=O)CC2=CC(=CC=C2)OC3=CC=CC=C3)Cl

InChI

InChI=1S/C24H24ClNO4S/c1-24(2,3)20-19(23(28)29-4)22(31-21(20)25)26-18(27)14-15-9-8-12-17(13-15)30-16-10-6-5-7-11-16/h5-13H,14H2,1-4H3,(H,26,27)