2-bromanyl-N-[[4-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[[4-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]benzamide Openeye Name: 2-bromo-N-[[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]benzamide CAS Name: 2-bromo-N-[[4-(5-chloro-1,3-benzoxazol-2-yl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]thiocarbamoyl]benzamide Formula: C21H13BrClN3O2S MolecularWeight: 486.76882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3=NC4=C(O3)C=CC(=C4)Cl)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3=NC4=C(O3)C=CC(=C4)Cl)Br

InChI

InChI=1S/C21H13BrClN3O2S/c22-16-4-2-1-3-15(16)19(27)26-21(29)24-14-8-5-12(6-9-14)20-25-17-11-13(23)7-10-18(17)28-20/h1-11H,(H2,24,26,27,29)