N-[(5-chloranyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-[(5-chloranyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide Openeye Name: N-[(5-chloro-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide CAS Name: N-[[(5-chloro-2,1,3-benzothiadiazol-4-yl)amino]-sulfanylidenemethyl]-5-(2-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[(5-chloro-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide Traditional Name: N-[(5-chloropiazthiol-4-yl)thiocarbamoyl]-5-(2-nitrophenyl)-2-furamide Formula: C18H10ClN5O4S2 MolecularWeight: 459.8861

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=C(C=CC4=NSN=C43)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=C(C=CC4=NSN=C43)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H10ClN5O4S2/c19-10-5-6-11-16(23-30-22-11)15(10)20-18(29)21-17(25)14-8-7-13(28-14)9-3-1-2-4-12(9)24(26)27/h1-8H,(H2,20,21,25,29)