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

Systemtic Name: ethyl 4-[2-(5-tert-butyl-2-methyl-phenyl)sulfanylethanoylamino]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C22H27NO3S MolecularWeight: 385.51968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=C(C=CC(=C2)C(C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=C(C=CC(=C2)C(C)(C)C)C

InChI

InChI=1S/C22H27NO3S/c1-6-26-21(25)16-8-11-18(12-9-16)23-20(24)14-27-19-13-17(22(3,4)5)10-7-15(19)2/h7-13H,6,14H2,1-5H3,(H,23,24)