5-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-4-nitro-thiophene-2-sulfonamide

Systemtic Name: 5-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-4-nitro-thiophene-2-sulfonamide Openeye Name: 5-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-4-nitro-thiophene-2-sulfonamide CAS Name: 5-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-4-nitro-2-thiophenesulfonamide IUPAC Name: 5-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-4-nitrothiophene-2-sulfonamide Traditional Name: 5-[4-(3-fluorophenyl)sulfonylpiperazino]-4-nitro-thiophene-2-sulfonamide Formula: C14H15FN4O6S3 MolecularWeight: 450.485503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(S2)S(=O)(=O)N)[N+](=O)[O-])S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

C1CN(CCN1C2=C(C=C(S2)S(=O)(=O)N)[N+](=O)[O-])S(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C14H15FN4O6S3/c15-10-2-1-3-11(8-10)28(24,25)18-6-4-17(5-7-18)14-12(19(20)21)9-13(26-14)27(16,22)23/h1-3,8-9H,4-7H2,(H2,16,22,23)