ethyl 4-[2-(2,3,5,6-tetramethylphenyl)sulfanylethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(2,3,5,6-tetramethylphenyl)sulfanylethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(2,3,5,6-tetramethylphenyl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[(2,3,5,6-tetramethylphenyl)thio]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(2,3,5,6-tetramethylphenyl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(2,3,5,6-tetramethylphenyl)thio]acetyl]amino]benzoic acid ethyl ester Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=C(C(=CC(=C2C)C)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=C(C(=CC(=C2C)C)C)C

InChI

InChI=1S/C21H25NO3S/c1-6-25-21(24)17-7-9-18(10-8-17)22-19(23)12-26-20-15(4)13(2)11-14(3)16(20)5/h7-11H,6,12H2,1-5H3,(H,22,23)