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

Systemtic Name: propyl 4-[2-(2,3,5,6-tetramethylphenyl)sulfanylethanoylamino]benzoate Openeye Name: propyl 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 propyl ester IUPAC Name: propyl 4-[[2-(2,3,5,6-tetramethylphenyl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(2,3,5,6-tetramethylphenyl)thio]acetyl]amino]benzoic acid propyl ester Formula: C22H27NO3S MolecularWeight: 385.51968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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