[2-[3-[methyl(phenyl)amino]propylamino]-2-oxidanylidene-ethyl] (E)-3-thiophen-2-ylprop-2-enoate

Systemtic Name: [2-[3-[methyl(phenyl)amino]propylamino]-2-oxidanylidene-ethyl] (E)-3-thiophen-2-ylprop-2-enoate Openeye Name: [2-[3-(N-methylanilino)propylamino]-2-oxo-ethyl] (E)-3-(2-thienyl)prop-2-enoate CAS Name: (E)-3-thiophen-2-yl-2-propenoic acid [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] ester IUPAC Name: [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] (E)-3-thiophen-2-ylprop-2-enoate Traditional Name: (E)-3-(2-thienyl)acrylic acid [2-keto-2-[3-(N-methylanilino)propylamino]ethyl] ester Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)COC(=O)C=CC1=CC=CS1)C2=CC=CC=C2

Isomeric SMILES

CN(CCCNC(=O)COC(=O)/C=C/C1=CC=CS1)C2=CC=CC=C2

InChI

InChI=1S/C19H22N2O3S/c1-21(16-7-3-2-4-8-16)13-6-12-20-18(22)15-24-19(23)11-10-17-9-5-14-25-17/h2-5,7-11,14H,6,12-13,15H2,1H3,(H,20,22)/b11-10+