methyl 5-aminocarbonyl-2-[[(E)-3-(5-chloranyl-2-pentoxy-phenyl)-2-cyano-prop-2-enoyl]amino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-aminocarbonyl-2-[[(E)-3-(5-chloranyl-2-pentoxy-phenyl)-2-cyano-prop-2-enoyl]amino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-carbamoyl-2-[[(E)-3-(5-chloro-2-pentoxy-phenyl)-2-cyano-prop-2-enoyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-carbamoyl-2-[[(E)-3-(5-chloro-2-pentoxyphenyl)-2-cyano-1-oxoprop-2-enyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-carbamoyl-2-[[(E)-3-(5-chloro-2-pentoxyphenyl)-2-cyanoprop-2-enoyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(2-amoxy-5-chloro-phenyl)-2-cyano-acryloyl]amino]-5-carbamoyl-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C23H24ClN3O5S MolecularWeight: 489.97176

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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(=O)N)C)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C23H24ClN3O5S/c1-4-5-6-9-32-17-8-7-16(24)11-14(17)10-15(12-25)21(29)27-22-18(23(30)31-3)13(2)19(33-22)20(26)28/h7-8,10-11H,4-6,9H2,1-3H3,(H2,26,28)(H,27,29)/b15-10+