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

Systemtic Name: propyl 4-[[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]benzoate Openeye Name: propyl 4-[[2-(4-ethylanilino)-2-oxo-ethyl]sulfanylmethyl]benzoate CAS Name: 4-[[[2-(4-ethylanilino)-2-oxoethyl]thio]methyl]benzoic acid propyl ester IUPAC Name: propyl 4-[[2-(4-ethylanilino)-2-oxoethyl]sulfanylmethyl]benzoate Traditional Name: 4-[[[2-(4-ethylanilino)-2-keto-ethyl]thio]methyl]benzoic acid propyl ester Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO3S/c1-3-13-25-21(24)18-9-5-17(6-10-18)14-26-15-20(23)22-19-11-7-16(4-2)8-12-19/h5-12H,3-4,13-15H2,1-2H3,(H,22,23)