2-[ethyl-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)amino]-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[ethyl-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)amino]-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-[N-ethyl-2-nitro-4-(1-piperidylsulfonyl)anilino]-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[N-ethyl-2-nitro-4-(1-piperidinylsulfonyl)anilino]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-(N-ethyl-2-nitro-4-piperidin-1-ylsulfonylanilino)-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-(N-ethyl-2-nitro-4-piperidinosulfonyl-anilino)-N-(4-fluorobenzyl)acetamide Formula: C22H27FN4O5S MolecularWeight: 478.536983

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=C(C=C1)F)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC(=O)NCC1=CC=C(C=C1)F)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C22H27FN4O5S/c1-2-25(16-22(28)24-15-17-6-8-18(23)9-7-17)20-11-10-19(14-21(20)27(29)30)33(31,32)26-12-4-3-5-13-26/h6-11,14H,2-5,12-13,15-16H2,1H3,(H,24,28)