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

Systemtic Name: N-[(5-chloranyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[(5-chloro-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[[(5-chloro-2,1,3-benzothiadiazol-4-yl)amino]-sulfanylidenemethyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[(5-chloro-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[(5-chloropiazthiol-4-yl)thiocarbamoyl]-3,4,5-trimethoxy-benzamide Formula: C17H15ClN4O4S2 MolecularWeight: 438.9084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=C(C=CC3=NSN=C32)Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=C(C=CC3=NSN=C32)Cl

InChI

InChI=1S/C17H15ClN4O4S2/c1-24-11-6-8(7-12(25-2)15(11)26-3)16(23)20-17(27)19-13-9(18)4-5-10-14(13)22-28-21-10/h4-7H,1-3H3,(H2,19,20,23,27)