methyl 4-[2-(4-tert-butylphenyl)sulfanylethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(4-tert-butylphenyl)sulfanylethanoylamino]benzoate Openeye Name: methyl 4-[[2-(4-tert-butylphenyl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[(4-tert-butylphenyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-tert-butylphenyl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(4-tert-butylphenyl)thio]acetyl]amino]benzoic acid methyl ester Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C20H23NO3S/c1-20(2,3)15-7-11-17(12-8-15)25-13-18(22)21-16-9-5-14(6-10-16)19(23)24-4/h5-12H,13H2,1-4H3,(H,21,22)