[4-[2-cyano-3-[(4-morpholin-4-ylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] thiophene-2-carboxylate

Systemtic Name: [4-[2-cyano-3-[(4-morpholin-4-ylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] thiophene-2-carboxylate Openeye Name: [4-[2-cyano-3-(4-morpholinoanilino)-3-oxo-prop-1-enyl]-2-methoxy-phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [4-[2-cyano-3-[4-(4-morpholinyl)anilino]-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[2-cyano-3-(4-morpholin-4-ylanilino)-3-oxoprop-1-enyl]-2-methoxyphenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [4-[2-cyano-3-keto-3-(4-morpholinoanilino)prop-1-enyl]-2-methoxy-phenyl] ester Formula: C26H23N3O5S MolecularWeight: 489.54292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)N3CCOCC3)OC(=O)C4=CC=CS4

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)N3CCOCC3)OC(=O)C4=CC=CS4

InChI

InChI=1S/C26H23N3O5S/c1-32-23-16-18(4-9-22(23)34-26(31)24-3-2-14-35-24)15-19(17-27)25(30)28-20-5-7-21(8-6-20)29-10-12-33-13-11-29/h2-9,14-16H,10-13H2,1H3,(H,28,30)