methyl 5-[(E)-dimethylaminomethylideneamino]-4-dimorpholin-4-ylphosphinothioyl-thiophene-2-carboxylate

Systemtic Name: methyl 5-[(E)-dimethylaminomethylideneamino]-4-dimorpholin-4-ylphosphinothioyl-thiophene-2-carboxylate Openeye Name: methyl 5-[(E)-dimethylaminomethyleneamino]-4-dimorpholinophosphinothioyl-thiophene-2-carboxylate CAS Name: 4-[bis(4-morpholinyl)phosphinothioyl]-5-[(E)-dimethylaminomethylideneamino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(E)-dimethylaminomethylideneamino]-4-dimorpholin-4-ylphosphinothioylthiophene-2-carboxylate Traditional Name: 5-[(E)-dimethylaminomethyleneamino]-4-dimorpholinothiophosphoryl-thiophene-2-carboxylic acid methyl ester Formula: C17H27N4O4PS2 MolecularWeight: 446.524441

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=NC1=C(C=C(S1)C(=O)OC)P(=S)(N2CCOCC2)N3CCOCC3

Isomeric SMILES

CN(C)/C=N/C1=C(C=C(S1)C(=O)OC)P(=S)(N2CCOCC2)N3CCOCC3

InChI

InChI=1S/C17H27N4O4PS2/c1-19(2)13-18-16-14(12-15(28-16)17(22)23-3)26(27,20-4-8-24-9-5-20)21-6-10-25-11-7-21/h12-13H,4-11H2,1-3H3/b18-13+