3-bromanyl-4-methoxy-N-(quinolin-5-ylcarbamothioyl)benzamide

Systemtic Name: 3-bromanyl-4-methoxy-N-(quinolin-5-ylcarbamothioyl)benzamide Openeye Name: 3-bromo-4-methoxy-N-(5-quinolylcarbamothioyl)benzamide CAS Name: 3-bromo-4-methoxy-N-[(5-quinolinylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-methoxy-N-(quinolin-5-ylcarbamothioyl)benzamide Traditional Name: 3-bromo-4-methoxy-N-(5-quinolylthiocarbamoyl)benzamide Formula: C18H14BrN3O2S MolecularWeight: 416.29166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC3=C2C=CC=N3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC3=C2C=CC=N3)Br

InChI

InChI=1S/C18H14BrN3O2S/c1-24-16-8-7-11(10-13(16)19)17(23)22-18(25)21-15-6-2-5-14-12(15)4-3-9-20-14/h2-10H,1H3,(H2,21,22,23,25)