ethyl 5-ethanoyl-4-methyl-2-[3-(3,4,5-trimethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-[3-(3,4,5-trimethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-4-methyl-2-[3-(3,4,5-trimethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[[1-oxo-3-(3,4,5-trimethoxyphenyl)prop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-[3-(3,4,5-trimethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate Traditional Name: 5-acetyl-4-methyl-2-[[3-(3,4,5-trimethoxyphenyl)acryloyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H25NO7S MolecularWeight: 447.5014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C=CC2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C=CC2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C22H25NO7S/c1-7-30-22(26)18-12(2)20(13(3)24)31-21(18)23-17(25)9-8-14-10-15(27-4)19(29-6)16(11-14)28-5/h8-11H,7H2,1-6H3,(H,23,25)