ethyl 2-[(3-azanyl-4-methoxy-phenyl)methylsulfanyl]ethanoate

Systemtic Name: ethyl 2-[(3-azanyl-4-methoxy-phenyl)methylsulfanyl]ethanoate Openeye Name: ethyl 2-[(3-amino-4-methoxy-phenyl)methylsulfanyl]acetate CAS Name: 2-[(3-amino-4-methoxyphenyl)methylthio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3-amino-4-methoxyphenyl)methylsulfanyl]acetate Traditional Name: 2-[(3-amino-4-methoxy-benzyl)thio]acetic acid ethyl ester Formula: C12H17NO3S MolecularWeight: 255.33328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC1=CC(=C(C=C1)OC)N

Isomeric SMILES

CCOC(=O)CSCC1=CC(=C(C=C1)OC)N

InChI

InChI=1S/C12H17NO3S/c1-3-16-12(14)8-17-7-9-4-5-11(15-2)10(13)6-9/h4-6H,3,7-8,13H2,1-2H3