(5-phenyl-1,2-oxazol-3-yl)methyl (E)-3-(4-methylsulfanylphenyl)prop-2-enoate

Systemtic Name: (5-phenyl-1,2-oxazol-3-yl)methyl (E)-3-(4-methylsulfanylphenyl)prop-2-enoate Openeye Name: (5-phenylisoxazol-3-yl)methyl (E)-3-(4-methylsulfanylphenyl)prop-2-enoate CAS Name: (E)-3-[4-(methylthio)phenyl]-2-propenoic acid (5-phenyl-3-isoxazolyl)methyl ester IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methyl (E)-3-(4-methylsulfanylphenyl)prop-2-enoate Traditional Name: (E)-3-[4-(methylthio)phenyl]acrylic acid (5-phenylisoxazol-3-yl)methyl ester Formula: C20H17NO3S MolecularWeight: 351.41888

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=CC(=O)OCC2=NOC(=C2)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C/C(=O)OCC2=NOC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H17NO3S/c1-25-18-10-7-15(8-11-18)9-12-20(22)23-14-17-13-19(24-21-17)16-5-3-2-4-6-16/h2-13H,14H2,1H3/b12-9+