5-bromanyl-N-[[3-chloranyl-4-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]-2-methoxy-3-methyl-benzamide

Systemtic Name: 5-bromanyl-N-[[3-chloranyl-4-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]-2-methoxy-3-methyl-benzamide Openeye Name: 5-bromo-N-[[3-chloro-4-(2-oxochromen-3-yl)phenyl]carbamothioyl]-2-methoxy-3-methyl-benzamide CAS Name: 5-bromo-N-[[3-chloro-4-(2-oxo-1-benzopyran-3-yl)anilino]-sulfanylidenemethyl]-2-methoxy-3-methylbenzamide IUPAC Name: 5-bromo-N-[[3-chloro-4-(2-oxochromen-3-yl)phenyl]carbamothioyl]-2-methoxy-3-methylbenzamide Traditional Name: 5-bromo-N-[[3-chloro-4-(2-ketochromen-3-yl)phenyl]thiocarbamoyl]-2-methoxy-3-methyl-benzamide Formula: C25H18BrClN2O4S MolecularWeight: 557.84342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=CC(=C(C=C2)C3=CC4=CC=CC=C4OC3=O)Cl)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=CC(=C(C=C2)C3=CC4=CC=CC=C4OC3=O)Cl)OC

InChI

InChI=1S/C25H18BrClN2O4S/c1-13-9-15(26)11-19(22(13)32-2)23(30)29-25(34)28-16-7-8-17(20(27)12-16)18-10-14-5-3-4-6-21(14)33-24(18)31/h3-12H,1-2H3,(H2,28,29,30,34)