N-[2-[4-(3-methylphenyl)piperazin-1-yl]sulfonylethyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[2-[4-(3-methylphenyl)piperazin-1-yl]sulfonylethyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[2-[4-(m-tolyl)piperazin-1-yl]sulfonylethyl]-5-nitro-furan-2-carboxamide CAS Name: N-[2-[[4-(3-methylphenyl)-1-piperazinyl]sulfonyl]ethyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[2-[4-(3-methylphenyl)piperazin-1-yl]sulfonylethyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[2-[4-(m-tolyl)piperazino]sulfonylethyl]-5-nitro-2-furamide Formula: C18H22N4O6S MolecularWeight: 422.45548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)CCNC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)CCNC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O6S/c1-14-3-2-4-15(13-14)20-8-10-21(11-9-20)29(26,27)12-7-19-18(23)16-5-6-17(28-16)22(24)25/h2-6,13H,7-12H2,1H3,(H,19,23)