[2-[[2,6-di(propan-2-yl)phenyl]amino]-2-oxidanylidene-ethyl] 2,5-dimethylthiophene-3-carboxylate

Systemtic Name: [2-[[2,6-di(propan-2-yl)phenyl]amino]-2-oxidanylidene-ethyl] 2,5-dimethylthiophene-3-carboxylate Openeye Name: [2-(2,6-diisopropylanilino)-2-oxo-ethyl] 2,5-dimethylthiophene-3-carboxylate CAS Name: 2,5-dimethyl-3-thiophenecarboxylic acid [2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl] 2,5-dimethylthiophene-3-carboxylate Traditional Name: 2,5-dimethylthiophene-3-carboxylic acid [2-(2,6-diisopropylanilino)-2-keto-ethyl] ester Formula: C21H27NO3S MolecularWeight: 373.50898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)OCC(=O)NC2=C(C=CC=C2C(C)C)C(C)C

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)OCC(=O)NC2=C(C=CC=C2C(C)C)C(C)C

InChI

InChI=1S/C21H27NO3S/c1-12(2)16-8-7-9-17(13(3)4)20(16)22-19(23)11-25-21(24)18-10-14(5)26-15(18)6/h7-10,12-13H,11H2,1-6H3,(H,22,23)