N-[4-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]carbonylphenyl]furan-2-carboxamide

Systemtic Name: N-[4-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]carbonylphenyl]furan-2-carboxamide Openeye Name: N-[4-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazine-1-carbonyl]phenyl]furan-2-carboxamide CAS Name: N-[4-[[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]-oxomethyl]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[4-(4-methylsulfonyl-2-nitrophenyl)piperazine-1-carbonyl]phenyl]furan-2-carboxamide Traditional Name: N-[4-[4-(4-mesyl-2-nitro-phenyl)piperazine-1-carbonyl]phenyl]-2-furamide Formula: C23H22N4O7S MolecularWeight: 498.50838

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C23H22N4O7S/c1-35(32,33)18-8-9-19(20(15-18)27(30)31)25-10-12-26(13-11-25)23(29)16-4-6-17(7-5-16)24-22(28)21-3-2-14-34-21/h2-9,14-15H,10-13H2,1H3,(H,24,28)