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

Systemtic Name: 3,5-bis(bromanyl)-2-methoxy-N-[[2-methyl-5-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]benzamide Openeye Name: 3,5-dibromo-2-methoxy-N-[[2-methyl-5-(2-oxochromen-3-yl)phenyl]carbamothioyl]benzamide CAS Name: 3,5-dibromo-2-methoxy-N-[[2-methyl-5-(2-oxo-1-benzopyran-3-yl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dibromo-2-methoxy-N-[[2-methyl-5-(2-oxochromen-3-yl)phenyl]carbamothioyl]benzamide Traditional Name: 3,5-dibromo-N-[[5-(2-ketochromen-3-yl)-2-methyl-phenyl]thiocarbamoyl]-2-methoxy-benzamide Formula: C25H18Br2N2O4S MolecularWeight: 602.29442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC3=CC=CC=C3OC2=O)NC(=S)NC(=O)C4=CC(=CC(=C4OC)Br)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC3=CC=CC=C3OC2=O)NC(=S)NC(=O)C4=CC(=CC(=C4OC)Br)Br

InChI

InChI=1S/C25H18Br2N2O4S/c1-13-7-8-14(17-9-15-5-3-4-6-21(15)33-24(17)31)10-20(13)28-25(34)29-23(30)18-11-16(26)12-19(27)22(18)32-2/h3-12H,1-2H3,(H2,28,29,30,34)