N-[[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]carbamothioyl]-5-bromanyl-2-methoxy-benzamide

Systemtic Name: N-[[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]carbamothioyl]-5-bromanyl-2-methoxy-benzamide Openeye Name: 5-bromo-N-[(4,5-dichloro-1,3-benzothiazol-2-yl)carbamothioyl]-2-methoxy-benzamide CAS Name: 5-bromo-N-[[(4,5-dichloro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 5-bromo-N-[(4,5-dichloro-1,3-benzothiazol-2-yl)carbamothioyl]-2-methoxybenzamide Traditional Name: 5-bromo-N-[(4,5-dichloro-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-methoxy-benzamide Formula: C16H10BrCl2N3O2S2 MolecularWeight: 491.2095

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=NC3=C(S2)C=CC(=C3Cl)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=NC3=C(S2)C=CC(=C3Cl)Cl

InChI

InChI=1S/C16H10BrCl2N3O2S2/c1-24-10-4-2-7(17)6-8(10)14(23)21-15(25)22-16-20-13-11(26-16)5-3-9(18)12(13)19/h2-6H,1H3,(H2,20,21,22,23,25)