ethyl 2-[3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[3-(4-ethoxy-3-methoxyphenyl)-1-oxoprop-2-enyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-ethoxy-3-methoxyphenyl)prop-2-enoylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[3-(4-ethoxy-3-methoxy-phenyl)acryloyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C(=C(S2)C)C)C(=O)OCC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C(=C(S2)C)C)C(=O)OCC)OC

InChI

InChI=1S/C21H25NO5S/c1-6-26-16-10-8-15(12-17(16)25-5)9-11-18(23)22-20-19(21(24)27-7-2)13(3)14(4)28-20/h8-12H,6-7H2,1-5H3,(H,22,23)