methyl 4-[2-(5-tert-butyl-2-methyl-phenyl)sulfanylethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(5-tert-butyl-2-methyl-phenyl)sulfanylethanoylamino]benzoate Openeye Name: methyl 4-[[2-(5-tert-butyl-2-methyl-phenyl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[(5-tert-butyl-2-methylphenyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(5-tert-butyl-2-methylphenyl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(5-tert-butyl-2-methyl-phenyl)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(C)(C)C)SCC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)SCC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C21H25NO3S/c1-14-6-9-16(21(2,3)4)12-18(14)26-13-19(23)22-17-10-7-15(8-11-17)20(24)25-5/h6-12H,13H2,1-5H3,(H,22,23)