methyl 2-[2-[(E)-2-cyano-3-(4-methylphenyl)prop-2-enoyl]oxyethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[(E)-2-cyano-3-(4-methylphenyl)prop-2-enoyl]oxyethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[(E)-2-cyano-3-(p-tolyl)prop-2-enoyl]oxyacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(E)-2-cyano-3-(4-methylphenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[(E)-2-cyano-3-(4-methylphenyl)prop-2-enoyl]oxyacetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-[(E)-2-cyano-3-(p-tolyl)acryloyl]oxyacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C#N)C(=O)OCC(=O)NC2=C(C(=C(S2)C)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C#N)/C(=O)OCC(=O)NC2=C(C(=C(S2)C)C)C(=O)OC

InChI

InChI=1S/C21H20N2O5S/c1-12-5-7-15(8-6-12)9-16(10-22)20(25)28-11-17(24)23-19-18(21(26)27-4)13(2)14(3)29-19/h5-9H,11H2,1-4H3,(H,23,24)/b16-9+