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

Systemtic Name: N-methyl-N-[2-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]furan-2-carboxamide Openeye Name: N-methyl-N-[2-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-methyl-N-[2-[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]-2-oxoethyl]-2-furancarboxamide IUPAC Name: N-methyl-N-[2-[4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]-2-oxoethyl]furan-2-carboxamide Traditional Name: N-[2-keto-2-[4-(4-mesyl-2-nitro-phenyl)piperazino]ethyl]-N-methyl-2-furamide Formula: C19H22N4O7S MolecularWeight: 450.46558

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C(=O)C3=CC=CO3

Isomeric SMILES

CN(CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C(=O)C3=CC=CO3

InChI

InChI=1S/C19H22N4O7S/c1-20(19(25)17-4-3-11-30-17)13-18(24)22-9-7-21(8-10-22)15-6-5-14(31(2,28)29)12-16(15)23(26)27/h3-6,11-12H,7-10,13H2,1-2H3