2,6-dimethoxy-N-[[3-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: 2,6-dimethoxy-N-[[3-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]benzamide Openeye Name: 2,6-dimethoxy-N-[[3-(2-oxochromen-3-yl)phenyl]carbamothioyl]benzamide CAS Name: 2,6-dimethoxy-N-[[3-(2-oxo-1-benzopyran-3-yl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2,6-dimethoxy-N-[[3-(2-oxochromen-3-yl)phenyl]carbamothioyl]benzamide Traditional Name: N-[[3-(2-ketochromen-3-yl)phenyl]thiocarbamoyl]-2,6-dimethoxy-benzamide Formula: C25H20N2O5S MolecularWeight: 460.5017

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)NC(=S)NC2=CC=CC(=C2)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)NC(=S)NC2=CC=CC(=C2)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C25H20N2O5S/c1-30-20-11-6-12-21(31-2)22(20)23(28)27-25(33)26-17-9-5-8-15(13-17)18-14-16-7-3-4-10-19(16)32-24(18)29/h3-14H,1-2H3,(H2,26,27,28,33)