4-azanyl-3',6'-bis(oxidanyl)-3-oxidanylidene-N-phenyl-spiro[2-benzofuran-1,9'-xanthene]-5-carbothioamide

Systemtic Name: 4-azanyl-3',6'-bis(oxidanyl)-3-oxidanylidene-N-phenyl-spiro[2-benzofuran-1,9'-xanthene]-5-carbothioamide Openeye Name: 4-amino-3',6'-dihydroxy-3-oxo-N-phenyl-spiro[isobenzofuran-1,9'-xanthene]-5-carbothioamide CAS Name: 4-amino-3',6'-dihydroxy-3-oxo-N-phenyl-5-spiro[isobenzofuran-1,9'-xanthene]carbothioamide IUPAC Name: 4-amino-3',6'-dihydroxy-3-oxo-N-phenylspiro[2-benzofuran-1,9'-xanthene]-5-carbothioamide Traditional Name: 4-amino-3',6'-dihydroxy-3-keto-N-phenyl-spiro[phthalan-1,9'-xanthene]-5-carbothioamide Formula: C27H18N2O5S MolecularWeight: 482.50722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)C2=C(C3=C(C=C2)C4(C5=C(C=C(C=C5)O)OC6=C4C=CC(=C6)O)OC3=O)N

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)C2=C(C3=C(C=C2)C4(C5=C(C=C(C=C5)O)OC6=C4C=CC(=C6)O)OC3=O)N

InChI

InChI=1S/C27H18N2O5S/c28-24-17(25(35)29-14-4-2-1-3-5-14)8-11-20-23(24)26(32)34-27(20)18-9-6-15(30)12-21(18)33-22-13-16(31)7-10-19(22)27/h1-13,30-31H,28H2,(H,29,35)