methyl 2-[[(E)-2-cyano-3-(2,3,4-trimethoxyphenyl)prop-2-enoyl]amino]-5-propyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(E)-2-cyano-3-(2,3,4-trimethoxyphenyl)prop-2-enoyl]amino]-5-propyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(E)-2-cyano-3-(2,3,4-trimethoxyphenyl)prop-2-enoyl]amino]-5-propyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-1-oxo-3-(2,3,4-trimethoxyphenyl)prop-2-enyl]amino]-5-propyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-2-cyano-3-(2,3,4-trimethoxyphenyl)prop-2-enoyl]amino]-5-propylthiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-(2,3,4-trimethoxyphenyl)acryloyl]amino]-5-propyl-thiophene-3-carboxylic acid methyl ester Formula: C22H24N2O6S MolecularWeight: 444.50076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(S1)NC(=O)C(=CC2=C(C(=C(C=C2)OC)OC)OC)C#N)C(=O)OC

Isomeric SMILES

CCCC1=CC(=C(S1)NC(=O)/C(=C/C2=C(C(=C(C=C2)OC)OC)OC)/C#N)C(=O)OC

InChI

InChI=1S/C22H24N2O6S/c1-6-7-15-11-16(22(26)30-5)21(31-15)24-20(25)14(12-23)10-13-8-9-17(27-2)19(29-4)18(13)28-3/h8-11H,6-7H2,1-5H3,(H,24,25)/b14-10+