methyl (E)-3-[4-(2-methylsulfanylethanoylamino)phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[4-(2-methylsulfanylethanoylamino)phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[4-[(2-methylsulfanylacetyl)amino]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[[2-(methylthio)-1-oxoethyl]amino]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-[(2-methylsulfanylacetyl)amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[[2-(methylthio)acetyl]amino]phenyl]acrylic acid methyl ester Formula: C13H15NO3S MolecularWeight: 265.3281

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC=C(C=C1)NC(=O)CSC

Isomeric SMILES

COC(=O)/C=C/C1=CC=C(C=C1)NC(=O)CSC

InChI

InChI=1S/C13H15NO3S/c1-17-13(16)8-5-10-3-6-11(7-4-10)14-12(15)9-18-2/h3-8H,9H2,1-2H3,(H,14,15)/b8-5+