5-(4-bromophenyl)-N-[(2-oxidanylidenechromen-6-yl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-[(2-oxidanylidenechromen-6-yl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(4-bromophenyl)-N-[(2-oxochromen-6-yl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(4-bromophenyl)-N-[[(2-oxo-1-benzopyran-6-yl)amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(4-bromophenyl)-N-[(2-oxochromen-6-yl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(4-bromophenyl)-N-[(2-ketochromen-6-yl)thiocarbamoyl]-2-furamide Formula: C21H13BrN2O4S MolecularWeight: 469.30792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(O2)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=O)C=C4)Br

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(O2)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=O)C=C4)Br

InChI

InChI=1S/C21H13BrN2O4S/c22-14-4-1-12(2-5-14)16-8-9-18(27-16)20(26)24-21(29)23-15-6-7-17-13(11-15)3-10-19(25)28-17/h1-11H,(H2,23,24,26,29)