N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-5-nitro-furan-2-carboxamide CAS Name: N-[4-(4-methylsulfonyl-1-piperazinyl)phenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[4-(4-mesylpiperazino)phenyl]-5-nitro-2-furamide Formula: C16H18N4O6S MolecularWeight: 394.40232

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O6S/c1-27(24,25)19-10-8-18(9-11-19)13-4-2-12(3-5-13)17-16(21)14-6-7-15(26-14)20(22)23/h2-7H,8-11H2,1H3,(H,17,21)