ethyl 2-[(5-azanyl-2-ethoxy-phenyl)methylsulfanyl]ethanoate

Systemtic Name: ethyl 2-[(5-azanyl-2-ethoxy-phenyl)methylsulfanyl]ethanoate Openeye Name: ethyl 2-[(5-amino-2-ethoxy-phenyl)methylsulfanyl]acetate CAS Name: 2-[(5-amino-2-ethoxyphenyl)methylthio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(5-amino-2-ethoxyphenyl)methylsulfanyl]acetate Traditional Name: 2-[(5-amino-2-ethoxy-benzyl)thio]acetic acid ethyl ester Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)N)CSCC(=O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)N)CSCC(=O)OCC

InChI

InChI=1S/C13H19NO3S/c1-3-16-12-6-5-11(14)7-10(12)8-18-9-13(15)17-4-2/h5-7H,3-4,8-9,14H2,1-2H3