3-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-N-(2-methyl-3-nitro-phenyl)propanamide

Systemtic Name: 3-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-N-(2-methyl-3-nitro-phenyl)propanamide Openeye Name: 3-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]-N-(2-methyl-3-nitro-phenyl)propanamide CAS Name: 3-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-N-(2-methyl-3-nitrophenyl)propanamide IUPAC Name: 3-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-N-(2-methyl-3-nitrophenyl)propanamide Traditional Name: 3-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-N-(2-methyl-3-nitro-phenyl)propionamide Formula: C20H22ClFN4O5S MolecularWeight: 484.928883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CCN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CCN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C20H22ClFN4O5S/c1-14-18(3-2-4-19(14)26(28)29)23-20(27)7-8-24-9-11-25(12-10-24)32(30,31)15-5-6-17(22)16(21)13-15/h2-6,13H,7-12H2,1H3,(H,23,27)