(2-azanyl-2-oxidanylidene-ethyl) 3-(4-methylsulfanylphenyl)prop-2-enoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 3-(4-methylsulfanylphenyl)prop-2-enoate Openeye Name: (2-amino-2-oxo-ethyl) 3-(4-methylsulfanylphenyl)prop-2-enoate CAS Name: 3-[4-(methylthio)phenyl]-2-propenoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 3-(4-methylsulfanylphenyl)prop-2-enoate Traditional Name: 3-[4-(methylthio)phenyl]acrylic acid (2-amino-2-keto-ethyl) ester Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=CC(=O)OCC(=O)N

Isomeric SMILES

CSC1=CC=C(C=C1)C=CC(=O)OCC(=O)N

InChI

InChI=1S/C12H13NO3S/c1-17-10-5-2-9(3-6-10)4-7-12(15)16-8-11(13)14/h2-7H,8H2,1H3,(H2,13,14)