N-[[3-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[[3-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[[3-(2-oxochromen-3-yl)phenyl]carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[[3-(2-oxo-1-benzopyran-3-yl)anilino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[[3-(2-oxochromen-3-yl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[[3-(2-ketochromen-3-yl)phenyl]thiocarbamoyl]coumarilamide Formula: C25H16N2O4S MolecularWeight: 440.47054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CC(=CC=C3)NC(=S)NC(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CC(=CC=C3)NC(=S)NC(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C25H16N2O4S/c28-23(22-14-17-7-2-3-10-20(17)30-22)27-25(32)26-18-9-5-8-15(12-18)19-13-16-6-1-4-11-21(16)31-24(19)29/h1-14H,(H2,26,27,28,32)