N-[(5-chloranyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[(5-chloranyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2,6-dimethoxy-benzamide Openeye Name: N-[(5-chloro-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2,6-dimethoxy-benzamide CAS Name: N-[[(5-chloro-2,1,3-benzothiadiazol-4-yl)amino]-sulfanylidenemethyl]-2,6-dimethoxybenzamide IUPAC Name: N-[(5-chloro-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2,6-dimethoxybenzamide Traditional Name: N-[(5-chloropiazthiol-4-yl)thiocarbamoyl]-2,6-dimethoxy-benzamide Formula: C16H13ClN4O3S2 MolecularWeight: 408.88242

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)NC(=S)NC2=C(C=CC3=NSN=C32)Cl

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)NC(=S)NC2=C(C=CC3=NSN=C32)Cl

InChI

InChI=1S/C16H13ClN4O3S2/c1-23-10-4-3-5-11(24-2)12(10)15(22)19-16(25)18-13-8(17)6-7-9-14(13)21-26-20-9/h3-7H,1-2H3,(H2,18,19,22,25)