ethyl 2-[2-[(3-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethylsulfanyl]ethanoate

Systemtic Name: ethyl 2-[2-[(3-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethylsulfanyl]ethanoate Openeye Name: ethyl 2-[2-[3-methoxy-N-(p-tolylsulfonyl)anilino]ethylsulfanyl]acetate CAS Name: 2-[2-(3-methoxy-N-(4-methylphenyl)sulfonylanilino)ethylthio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-methoxy-N-(4-methylphenyl)sulfonylanilino)ethylsulfanyl]acetate Traditional Name: 2-[2-(3-methoxy-N-tosyl-anilino)ethylthio]acetic acid ethyl ester Formula: C20H25NO5S2 MolecularWeight: 423.5462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCCN(C1=CC(=CC=C1)OC)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)CSCCN(C1=CC(=CC=C1)OC)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H25NO5S2/c1-4-26-20(22)15-27-13-12-21(17-6-5-7-18(14-17)25-3)28(23,24)19-10-8-16(2)9-11-19/h5-11,14H,4,12-13,15H2,1-3H3