N-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonylethyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]sulfonylethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonylethyl]-4-methyl-3-nitro-benzamide CAS Name: N-[2-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]sulfonyl]ethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]sulfonylethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[2-[4-(2-furoyl)piperazino]sulfonylethyl]-4-methyl-3-nitro-benzamide Formula: C19H22N4O7S MolecularWeight: 450.46558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCS(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCS(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O7S/c1-14-4-5-15(13-16(14)23(26)27)18(24)20-6-12-31(28,29)22-9-7-21(8-10-22)19(25)17-3-2-11-30-17/h2-5,11,13H,6-10,12H2,1H3,(H,20,24)