4-[[[(Z)-(5-dibenzofuran-4-yl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]carbamothioylamino]benzoic acid

Systemtic Name: 4-[[[(Z)-(5-dibenzofuran-4-yl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]carbamothioylamino]benzoic acid Openeye Name: 4-[[[(Z)-(5-dibenzofuran-4-yl-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]carbamothioylamino]benzoic acid CAS Name: 4-[[[[(Z)-[5-(4-dibenzofuranyl)-6-oxo-1-cyclohexa-2,4-dienylidene]methyl]hydrazo]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 4-[[[(Z)-(5-dibenzofuran-4-yl-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]carbamothioylamino]benzoic acid Traditional Name: 4-[[[(Z)-(5-dibenzofuran-4-yl-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]amino]thiocarbamoylamino]benzoic acid Formula: C27H19N3O4S MolecularWeight: 481.52246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C4=CC=CC(=CNNC(=S)NC5=CC=C(C=C5)C(=O)O)C4=O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C4=CC=C/C(=C/NNC(=S)NC5=CC=C(C=C5)C(=O)O)/C4=O

InChI

InChI=1S/C27H19N3O4S/c31-24-17(15-28-30-27(35)29-18-13-11-16(12-14-18)26(32)33)5-3-7-20(24)22-9-4-8-21-19-6-1-2-10-23(19)34-25(21)22/h1-15,28H,(H,32,33)(H2,29,30,35)/b17-15-