3-bromanyl-4-methoxy-N-[(6-oxidanyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-methoxy-N-[(6-oxidanyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide Openeye Name: 3-bromo-N-[(6-hydroxy-1,3-benzothiazol-2-yl)carbamothioyl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[[(6-hydroxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[(6-hydroxy-1,3-benzothiazol-2-yl)carbamothioyl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[(6-hydroxy-1,3-benzothiazol-2-yl)thiocarbamoyl]-4-methoxy-benzamide Formula: C16H12BrN3O3S2 MolecularWeight: 438.31878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)O)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)O)Br

InChI

InChI=1S/C16H12BrN3O3S2/c1-23-12-5-2-8(6-10(12)17)14(22)19-15(24)20-16-18-11-4-3-9(21)7-13(11)25-16/h2-7,21H,1H3,(H2,18,19,20,22,24)