ethyl 2-[2-[(4-dimethylaminophenyl)-oxidanyl-amino]-4-methoxy-6-oxidanylidene-pyran-3-yl]-2-phenyl-2-sulfanyl-ethanoate

Systemtic Name: ethyl 2-[2-[(4-dimethylaminophenyl)-oxidanyl-amino]-4-methoxy-6-oxidanylidene-pyran-3-yl]-2-phenyl-2-sulfanyl-ethanoate Openeye Name: ethyl 2-[2-[4-(dimethylamino)-N-hydroxy-anilino]-4-methoxy-6-oxo-pyran-3-yl]-2-phenyl-2-sulfanyl-acetate CAS Name: 2-[2-[4-(dimethylamino)-N-hydroxyanilino]-4-methoxy-6-oxo-3-pyranyl]-2-mercapto-2-phenylacetic acid ethyl ester IUPAC Name: ethyl 2-[2-[4-(dimethylamino)-N-hydroxyanilino]-4-methoxy-6-oxopyran-3-yl]-2-phenyl-2-sulfanylacetate Traditional Name: 2-[2-[4-(dimethylamino)-N-hydroxy-anilino]-6-keto-4-methoxy-pyran-3-yl]-2-mercapto-2-phenyl-acetic acid ethyl ester Formula: C24H26N2O6S MolecularWeight: 470.53804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)(C2=C(OC(=O)C=C2OC)N(C3=CC=C(C=C3)N(C)C)O)S

Isomeric SMILES

CCOC(=O)C(C1=CC=CC=C1)(C2=C(OC(=O)C=C2OC)N(C3=CC=C(C=C3)N(C)C)O)S

InChI

InChI=1S/C24H26N2O6S/c1-5-31-23(28)24(33,16-9-7-6-8-10-16)21-19(30-4)15-20(27)32-22(21)26(29)18-13-11-17(12-14-18)25(2)3/h6-15,29,33H,5H2,1-4H3