ethyl 4-[3-[3-(4-aminophenyl)-1-oxidanyl-3-oxidanylidene-propyl]-2-sulfanylidene-pyridin-1-yl]benzoate

Systemtic Name: ethyl 4-[3-[3-(4-aminophenyl)-1-oxidanyl-3-oxidanylidene-propyl]-2-sulfanylidene-pyridin-1-yl]benzoate Openeye Name: ethyl 4-[3-[3-(4-aminophenyl)-1-hydroxy-3-oxo-propyl]-2-thioxo-1-pyridyl]benzoate CAS Name: 4-[3-[3-(4-aminophenyl)-1-hydroxy-3-oxopropyl]-2-sulfanylidene-1-pyridinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-[3-(4-aminophenyl)-1-hydroxy-3-oxopropyl]-2-sulfanylidenepyridin-1-yl]benzoate Traditional Name: 4-[3-[3-(4-aminophenyl)-1-hydroxy-3-keto-propyl]-2-thioxo-1-pyridyl]benzoic acid ethyl ester Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C=CC=C(C2=S)C(CC(=O)C3=CC=C(C=C3)N)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C=CC=C(C2=S)C(CC(=O)C3=CC=C(C=C3)N)O

InChI

InChI=1S/C23H22N2O4S/c1-2-29-23(28)16-7-11-18(12-8-16)25-13-3-4-19(22(25)30)21(27)14-20(26)15-5-9-17(24)10-6-15/h3-13,21,27H,2,14,24H2,1H3