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

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-[3-(4-phenylmethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[3-(4-benzyloxyphenyl)prop-2-enoylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[[1-oxo-3-(4-phenylmethoxyphenyl)prop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-[3-(4-phenylmethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate Traditional Name: 5-acetyl-2-[[3-(4-benzoxyphenyl)acryloyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C26H25NO5S MolecularWeight: 463.5454

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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)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C=CC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C26H25NO5S/c1-4-31-26(30)23-17(2)24(18(3)28)33-25(23)27-22(29)15-12-19-10-13-21(14-11-19)32-16-20-8-6-5-7-9-20/h5-15H,4,16H2,1-3H3,(H,27,29)