3,5-bis(bromanyl)-2-methoxy-N-[(2-oxidanylidenechromen-6-yl)carbamothioyl]benzamide

Systemtic Name: 3,5-bis(bromanyl)-2-methoxy-N-[(2-oxidanylidenechromen-6-yl)carbamothioyl]benzamide Openeye Name: 3,5-dibromo-2-methoxy-N-[(2-oxochromen-6-yl)carbamothioyl]benzamide CAS Name: 3,5-dibromo-2-methoxy-N-[[(2-oxo-1-benzopyran-6-yl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dibromo-2-methoxy-N-[(2-oxochromen-6-yl)carbamothioyl]benzamide Traditional Name: 3,5-dibromo-N-[(2-ketochromen-6-yl)thiocarbamoyl]-2-methoxy-benzamide Formula: C18H12Br2N2O4S MolecularWeight: 512.17188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=O)C=C3)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=O)C=C3)Br)Br

InChI

InChI=1S/C18H12Br2N2O4S/c1-25-16-12(7-10(19)8-13(16)20)17(24)22-18(27)21-11-3-4-14-9(6-11)2-5-15(23)26-14/h2-8H,1H3,(H2,21,22,24,27)