ethyl 2-[2-(dimethylamino)ethenyl]-5-dimorpholin-4-ylphosphoryl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(dimethylamino)ethenyl]-5-dimorpholin-4-ylphosphoryl-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-(dimethylamino)vinyl]-5-dimorpholinophosphoryl-4-phenyl-thiophene-3-carboxylate CAS Name: 5-[bis(4-morpholinyl)phosphoryl]-2-[2-(dimethylamino)ethenyl]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(dimethylamino)ethenyl]-5-dimorpholin-4-ylphosphoryl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[2-(dimethylamino)vinyl]-5-dimorpholinophosphoryl-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H34N3O5PS MolecularWeight: 519.593321

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)P(=O)(N3CCOCC3)N4CCOCC4)C=CN(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)P(=O)(N3CCOCC3)N4CCOCC4)C=CN(C)C

InChI

InChI=1S/C25H34N3O5PS/c1-4-33-24(29)23-21(10-11-26(2)3)35-25(22(23)20-8-6-5-7-9-20)34(30,27-12-16-31-17-13-27)28-14-18-32-19-15-28/h5-11H,4,12-19H2,1-3H3