propyl 4-[[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]benzoate

Systemtic Name: propyl 4-[[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]benzoate Openeye Name: propyl 4-[[2-(4-ethoxyanilino)-2-oxo-ethyl]sulfanylmethyl]benzoate CAS Name: 4-[[[2-(4-ethoxyanilino)-2-oxoethyl]thio]methyl]benzoic acid propyl ester IUPAC Name: propyl 4-[[2-(4-ethoxyanilino)-2-oxoethyl]sulfanylmethyl]benzoate Traditional Name: 4-[[[2-keto-2-(p-phenetidino)ethyl]thio]methyl]benzoic acid propyl ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)CSCC(=O)NC2=CC=C(C=C2)OCC

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)CSCC(=O)NC2=CC=C(C=C2)OCC

InChI

InChI=1S/C21H25NO4S/c1-3-13-26-21(24)17-7-5-16(6-8-17)14-27-15-20(23)22-18-9-11-19(12-10-18)25-4-2/h5-12H,3-4,13-15H2,1-2H3,(H,22,23)