N-[[1,3-bis(oxidanylidene)-2-phenyl-isoindol-4-yl]carbamothioyl]furan-2-carboxamide

Systemtic Name: N-[[1,3-bis(oxidanylidene)-2-phenyl-isoindol-4-yl]carbamothioyl]furan-2-carboxamide Openeye Name: N-[(1,3-dioxo-2-phenyl-isoindolin-4-yl)carbamothioyl]furan-2-carboxamide CAS Name: N-[[(1,3-dioxo-2-phenyl-4-isoindolyl)amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-[(1,3-dioxo-2-phenylisoindol-4-yl)carbamothioyl]furan-2-carboxamide Traditional Name: N-[(1,3-diketo-2-phenyl-isoindolin-4-yl)thiocarbamoyl]-2-furamide Formula: C20H13N3O4S MolecularWeight: 391.39992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)NC(=S)NC(=O)C4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)NC(=S)NC(=O)C4=CC=CO4

InChI

InChI=1S/C20H13N3O4S/c24-17(15-10-5-11-27-15)22-20(28)21-14-9-4-8-13-16(14)19(26)23(18(13)25)12-6-2-1-3-7-12/h1-11H,(H2,21,22,24,28)