ethyl 2-[[(E)-2-cyano-3-(4-cyclohexylcarbonyloxy-3-ethoxy-phenyl)prop-2-enoyl]amino]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(E)-2-cyano-3-(4-cyclohexylcarbonyloxy-3-ethoxy-phenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[(E)-2-cyano-3-[4-(cyclohexanecarbonyloxy)-3-ethoxy-phenyl]prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-3-[4-[cyclohexyl(oxo)methoxy]-3-ethoxyphenyl]-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-2-cyano-3-[4-(cyclohexanecarbonyloxy)-3-ethoxyphenyl]prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-[4-(cyclohexanecarbonyloxy)-3-ethoxy-phenyl]acryloyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C26H28N2O6S MolecularWeight: 496.57532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=C(C=CS2)C(=O)OCC)OC(=O)C3CCCCC3

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC2=C(C=CS2)C(=O)OCC)OC(=O)C3CCCCC3

InChI

InChI=1S/C26H28N2O6S/c1-3-32-22-15-17(10-11-21(22)34-25(30)18-8-6-5-7-9-18)14-19(16-27)23(29)28-24-20(12-13-35-24)26(31)33-4-2/h10-15,18H,3-9H2,1-2H3,(H,28,29)/b19-14+