4-[3-[(3Z)-3-(morpholin-4-ylcarbonylhydrazinylidene)-2-oxidanylidene-1-pentyl-indol-5-yl]sulfanylpropyl]benzoic acid

Systemtic Name: 4-[3-[(3Z)-3-(morpholin-4-ylcarbonylhydrazinylidene)-2-oxidanylidene-1-pentyl-indol-5-yl]sulfanylpropyl]benzoic acid Openeye Name: 4-[3-[(3Z)-3-(morpholine-4-carbonylhydrazono)-2-oxo-1-pentyl-indolin-5-yl]sulfanylpropyl]benzoic acid CAS Name: 4-[3-[[(3Z)-3-[[4-morpholinyl(oxo)methyl]hydrazinylidene]-2-oxo-1-pentyl-5-indolyl]thio]propyl]benzoic acid IUPAC Name: 4-[3-[(3Z)-3-(morpholine-4-carbonylhydrazinylidene)-2-oxo-1-pentylindol-5-yl]sulfanylpropyl]benzoic acid Traditional Name: 4-[3-[[(3Z)-1-amyl-2-keto-3-(morpholine-4-carbonylhydrazono)indolin-5-yl]thio]propyl]benzoic acid Formula: C28H34N4O5S MolecularWeight: 538.65836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(C=C(C=C2)SCCCC3=CC=C(C=C3)C(=O)O)C(=NNC(=O)N4CCOCC4)C1=O

Isomeric SMILES

CCCCCN1C2=C(C=C(C=C2)SCCCC3=CC=C(C=C3)C(=O)O)/C(=N/NC(=O)N4CCOCC4)/C1=O

InChI

InChI=1S/C28H34N4O5S/c1-2-3-4-13-32-24-12-11-22(38-18-5-6-20-7-9-21(10-8-20)27(34)35)19-23(24)25(26(32)33)29-30-28(36)31-14-16-37-17-15-31/h7-12,19H,2-6,13-18H2,1H3,(H,30,36)(H,34,35)/b29-25-