methyl 4,5-dimethyl-2-[2-[(E)-3-quinolin-2-ylprop-2-enoyl]oxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[2-[(E)-3-quinolin-2-ylprop-2-enoyl]oxyethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[[2-[(E)-3-(2-quinolyl)prop-2-enoyl]oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-2-[(E)-1-oxo-3-(2-quinolinyl)prop-2-enoxy]ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[[2-[(E)-3-quinolin-2-ylprop-2-enoyl]oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[2-[(E)-3-(2-quinolyl)acryloyl]oxyacetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C22H20N2O5S MolecularWeight: 424.4696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C=CC2=NC3=CC=CC=C3C=C2)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)/C=C/C2=NC3=CC=CC=C3C=C2)C

InChI

InChI=1S/C22H20N2O5S/c1-13-14(2)30-21(20(13)22(27)28-3)24-18(25)12-29-19(26)11-10-16-9-8-15-6-4-5-7-17(15)23-16/h4-11H,12H2,1-3H3,(H,24,25)/b11-10+