N-[(E)-1-(furan-2-yl)-2-nitro-3-thiophen-2-yl-prop-2-enyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(E)-1-(furan-2-yl)-2-nitro-3-thiophen-2-yl-prop-2-enyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(E)-1-(2-furyl)-2-nitro-3-(2-thienyl)allyl]-4-methyl-benzenesulfonamide CAS Name: N-[(E)-1-(2-furanyl)-2-nitro-3-thiophen-2-ylprop-2-enyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(E)-1-(furan-2-yl)-2-nitro-3-thiophen-2-ylprop-2-enyl]-4-methylbenzenesulfonamide Traditional Name: N-[(E)-1-(2-furyl)-2-nitro-3-(2-thienyl)allyl]-4-methyl-benzenesulfonamide Formula: C18H16N2O5S2 MolecularWeight: 404.46004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CO2)C(=CC3=CC=CS3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CO2)/C(=C\C3=CC=CS3)/[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O5S2/c1-13-6-8-15(9-7-13)27(23,24)19-18(17-5-2-10-25-17)16(20(21)22)12-14-4-3-11-26-14/h2-12,18-19H,1H3/b16-12+