N-(furan-2-ylmethyl)-2-[2-[methylsulfonyl-(3-nitrophenyl)amino]ethanoylamino]benzamide

Systemtic Name: N-(furan-2-ylmethyl)-2-[2-[methylsulfonyl-(3-nitrophenyl)amino]ethanoylamino]benzamide Openeye Name: N-(2-furylmethyl)-2-[[2-(N-methylsulfonyl-3-nitro-anilino)acetyl]amino]benzamide CAS Name: N-(2-furanylmethyl)-2-[[2-(N-methylsulfonyl-3-nitroanilino)-1-oxoethyl]amino]benzamide IUPAC Name: N-(furan-2-ylmethyl)-2-[[2-(N-methylsulfonyl-3-nitroanilino)acetyl]amino]benzamide Traditional Name: N-(2-furfuryl)-2-[[2-(N-mesyl-3-nitro-anilino)acetyl]amino]benzamide Formula: C21H20N4O7S MolecularWeight: 472.4711

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)NCC2=CC=CO2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)NCC2=CC=CO2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O7S/c1-33(30,31)24(15-6-4-7-16(12-15)25(28)29)14-20(26)23-19-10-3-2-9-18(19)21(27)22-13-17-8-5-11-32-17/h2-12H,13-14H2,1H3,(H,22,27)(H,23,26)