methyl 2-[[(Z)-2-cyano-3-(3-pentoxyphenyl)prop-2-enoyl]amino]-5-propyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(Z)-2-cyano-3-(3-pentoxyphenyl)prop-2-enoyl]amino]-5-propyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(Z)-2-cyano-3-(3-pentoxyphenyl)prop-2-enoyl]amino]-5-propyl-thiophene-3-carboxylate CAS Name: 2-[[(Z)-2-cyano-1-oxo-3-(3-pentoxyphenyl)prop-2-enyl]amino]-5-propyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(Z)-2-cyano-3-(3-pentoxyphenyl)prop-2-enoyl]amino]-5-propylthiophene-3-carboxylate Traditional Name: 2-[[(Z)-3-(3-amoxyphenyl)-2-cyano-acryloyl]amino]-5-propyl-thiophene-3-carboxylic acid methyl ester Formula: C24H28N2O4S MolecularWeight: 440.55512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C=C(C#N)C(=O)NC2=C(C=C(S2)CCC)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C24H28N2O4S/c1-4-6-7-12-30-19-11-8-10-17(14-19)13-18(16-25)22(27)26-23-21(24(28)29-3)15-20(31-23)9-5-2/h8,10-11,13-15H,4-7,9,12H2,1-3H3,(H,26,27)/b18-13-