[2-[methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 3-(4-methylsulfanylphenyl)prop-2-enoate

Systemtic Name: [2-[methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 3-(4-methylsulfanylphenyl)prop-2-enoate Openeye Name: [2-[benzyl(methyl)amino]-2-oxo-ethyl] 3-(4-methylsulfanylphenyl)prop-2-enoate CAS Name: 3-[4-(methylthio)phenyl]-2-propenoic acid [2-[methyl-(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[benzyl(methyl)amino]-2-oxoethyl] 3-(4-methylsulfanylphenyl)prop-2-enoate Traditional Name: 3-[4-(methylthio)phenyl]acrylic acid [2-[benzyl(methyl)amino]-2-keto-ethyl] ester Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)COC(=O)C=CC2=CC=C(C=C2)SC

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)COC(=O)C=CC2=CC=C(C=C2)SC

InChI

InChI=1S/C20H21NO3S/c1-21(14-17-6-4-3-5-7-17)19(22)15-24-20(23)13-10-16-8-11-18(25-2)12-9-16/h3-13H,14-15H2,1-2H3