[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] (E)-3-(5-methylthiophen-2-yl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] (E)-3-(5-methylthiophen-2-yl)prop-2-enoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] (E)-3-(5-methyl-2-thienyl)prop-2-enoate CAS Name: (E)-3-(5-methyl-2-thiophenyl)-2-propenoic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] (E)-3-(5-methylthiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-methyl-2-thienyl)acrylic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C19H21NO3S2 MolecularWeight: 375.50494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=CC(=O)OCC(=O)NCCCSC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(S1)/C=C/C(=O)OCC(=O)NCCCSC2=CC=CC=C2

InChI

InChI=1S/C19H21NO3S2/c1-15-8-9-17(25-15)10-11-19(22)23-14-18(21)20-12-5-13-24-16-6-3-2-4-7-16/h2-4,6-11H,5,12-14H2,1H3,(H,20,21)/b11-10+