[1-[2-(2-fluorophenyl)sulfanyl-5-nitro-phenyl]carbonylpiperidin-4-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-[2-(2-fluorophenyl)sulfanyl-5-nitro-phenyl]carbonylpiperidin-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-[2-(2-fluorophenyl)sulfanyl-5-nitro-benzoyl]-4-piperidyl]-(1-piperidyl)methanone CAS Name: [1-[[2-[(2-fluorophenyl)thio]-5-nitrophenyl]-oxomethyl]-4-piperidinyl]-(1-piperidinyl)methanone IUPAC Name: [1-[2-(2-fluorophenyl)sulfanyl-5-nitrobenzoyl]piperidin-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-[2-[(2-fluorophenyl)thio]-5-nitro-benzoyl]-4-piperidyl]-piperidino-methanone Formula: C24H26FN3O4S MolecularWeight: 471.544343

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])SC4=CC=CC=C4F

Isomeric SMILES

C1CCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])SC4=CC=CC=C4F

InChI

InChI=1S/C24H26FN3O4S/c25-20-6-2-3-7-22(20)33-21-9-8-18(28(31)32)16-19(21)24(30)27-14-10-17(11-15-27)23(29)26-12-4-1-5-13-26/h2-3,6-9,16-17H,1,4-5,10-15H2