3-azanyl-4-[(4-methoxyphenyl)methylsulfanyl]butan-2-one

Systemtic Name: 3-azanyl-4-[(4-methoxyphenyl)methylsulfanyl]butan-2-one Openeye Name: 3-amino-4-[(4-methoxyphenyl)methylsulfanyl]butan-2-one CAS Name: 3-amino-4-[(4-methoxyphenyl)methylthio]-2-butanone IUPAC Name: 3-amino-4-[(4-methoxyphenyl)methylsulfanyl]butan-2-one Traditional Name: 3-amino-4-(p-anisylthio)butan-2-one Formula: C12H17NO2S MolecularWeight: 239.33388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO2S/c1-9(14)12(13)8-16-7-10-3-5-11(15-2)6-4-10/h3-6,12H,7-8,13H2,1-2H3