ethyl 3-azanyl-4-diethoxyphosphoryl-2-ethanoyl-5-phenylimino-thiophene-2-carboxylate

Systemtic Name: ethyl 3-azanyl-4-diethoxyphosphoryl-2-ethanoyl-5-phenylimino-thiophene-2-carboxylate Openeye Name: ethyl 2-acetyl-3-amino-4-diethoxyphosphoryl-5-phenylimino-thiophene-2-carboxylate CAS Name: 2-acetyl-3-amino-4-diethoxyphosphoryl-5-phenylimino-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-acetyl-3-amino-4-diethoxyphosphoryl-5-phenyliminothiophene-2-carboxylate Traditional Name: 2-acetyl-3-amino-4-diethoxyphosphoryl-5-phenylimino-thiophene-2-carboxylic acid ethyl ester Formula: C19H25N2O6PS MolecularWeight: 440.450361

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=C(C(=NC2=CC=CC=C2)S1)P(=O)(OCC)OCC)N)C(=O)C

Isomeric SMILES

CCOC(=O)C1(C(=C(C(=NC2=CC=CC=C2)S1)P(=O)(OCC)OCC)N)C(=O)C

InChI

InChI=1S/C19H25N2O6PS/c1-5-25-18(23)19(13(4)22)16(20)15(28(24,26-6-2)27-7-3)17(29-19)21-14-11-9-8-10-12-14/h8-12H,5-7,20H2,1-4H3