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

Systemtic Name: N-[(5-chloranyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-4-phenylmethoxy-benzamide Openeye Name: 4-benzyloxy-N-[(5-chloro-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide CAS Name: N-[[(5-chloro-2,1,3-benzothiadiazol-4-yl)amino]-sulfanylidenemethyl]-4-phenylmethoxybenzamide IUPAC Name: N-[(5-chloro-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-4-phenylmethoxybenzamide Traditional Name: 4-benzoxy-N-[(5-chloropiazthiol-4-yl)thiocarbamoyl]benzamide Formula: C21H15ClN4O2S2 MolecularWeight: 454.9524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NC(=S)NC3=C(C=CC4=NSN=C43)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NC(=S)NC3=C(C=CC4=NSN=C43)Cl

InChI

InChI=1S/C21H15ClN4O2S2/c22-16-10-11-17-19(26-30-25-17)18(16)23-21(29)24-20(27)14-6-8-15(9-7-14)28-12-13-4-2-1-3-5-13/h1-11H,12H2,(H2,23,24,27,29)