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

Systemtic Name: 2-bromanyl-N-[[3-chloranyl-4-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]benzamide Openeye Name: 2-bromo-N-[[3-chloro-4-(2-oxochromen-3-yl)phenyl]carbamothioyl]benzamide CAS Name: 2-bromo-N-[[3-chloro-4-(2-oxo-1-benzopyran-3-yl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[[3-chloro-4-(2-oxochromen-3-yl)phenyl]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[3-chloro-4-(2-ketochromen-3-yl)phenyl]thiocarbamoyl]benzamide Formula: C23H14BrClN2O3S MolecularWeight: 513.79086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C3=C(C=C(C=C3)NC(=S)NC(=O)C4=CC=CC=C4Br)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)C3=C(C=C(C=C3)NC(=S)NC(=O)C4=CC=CC=C4Br)Cl

InChI

InChI=1S/C23H14BrClN2O3S/c24-18-7-3-2-6-16(18)21(28)27-23(31)26-14-9-10-15(19(25)12-14)17-11-13-5-1-4-8-20(13)30-22(17)29/h1-12H,(H2,26,27,28,31)