N-(benzamidocarbamothioyl)-3-bromanyl-4-(2-methoxyethoxy)benzamide

Systemtic Name: N-(benzamidocarbamothioyl)-3-bromanyl-4-(2-methoxyethoxy)benzamide Openeye Name: N-(benzamidocarbamothioyl)-3-bromo-4-(2-methoxyethoxy)benzamide CAS Name: N-[(benzoylhydrazo)-sulfanylidenemethyl]-3-bromo-4-(2-methoxyethoxy)benzamide IUPAC Name: N-(benzamidocarbamothioyl)-3-bromo-4-(2-methoxyethoxy)benzamide Traditional Name: N-(benzamidothiocarbamoyl)-3-bromo-4-(2-methoxyethoxy)benzamide Formula: C18H18BrN3O4S MolecularWeight: 452.32222

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2)Br

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2)Br

InChI

InChI=1S/C18H18BrN3O4S/c1-25-9-10-26-15-8-7-13(11-14(15)19)16(23)20-18(27)22-21-17(24)12-5-3-2-4-6-12/h2-8,11H,9-10H2,1H3,(H,21,24)(H2,20,22,23,27)