3-chloranyl-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-6-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-6-nitro-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-(2-furylmethylsulfamoyl)phenyl]-6-nitro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-(2-furanylmethylsulfamoyl)phenyl]-6-nitro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-6-nitro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-(2-furfurylsulfamoyl)phenyl]-6-nitro-benzothiophene-2-carboxamide Formula: C20H14ClN3O6S2 MolecularWeight: 491.92466

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=COC(=C1)CNS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H14ClN3O6S2/c21-18-16-8-5-13(24(26)27)10-17(16)31-19(18)20(25)23-12-3-6-15(7-4-12)32(28,29)22-11-14-2-1-9-30-14/h1-10,22H,11H2,(H,23,25)