ethyl 2-[[(E)-3-(5-chloranyl-2-pentoxy-phenyl)-2-cyano-prop-2-enoyl]amino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(E)-3-(5-chloranyl-2-pentoxy-phenyl)-2-cyano-prop-2-enoyl]amino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[(E)-3-(5-chloro-2-pentoxy-phenyl)-2-cyano-prop-2-enoyl]amino]-5-isopropyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-3-(5-chloro-2-pentoxyphenyl)-2-cyano-1-oxoprop-2-enyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-3-(5-chloro-2-pentoxyphenyl)-2-cyanoprop-2-enoyl]amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(2-amoxy-5-chloro-phenyl)-2-cyano-acryloyl]amino]-5-isopropyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H29ClN2O4S MolecularWeight: 489.02676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)Cl)C=C(C#N)C(=O)NC2=C(C=C(S2)C(C)C)C(=O)OCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)Cl)/C=C(\C#N)/C(=O)NC2=C(C=C(S2)C(C)C)C(=O)OCC

InChI

InChI=1S/C25H29ClN2O4S/c1-5-7-8-11-32-21-10-9-19(26)13-17(21)12-18(15-27)23(29)28-24-20(25(30)31-6-2)14-22(33-24)16(3)4/h9-10,12-14,16H,5-8,11H2,1-4H3,(H,28,29)/b18-12+