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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC2=C(C(=CC(=C2C)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC2=C(C(=CC(=C2C)C)C)C

InChI

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