N-(5-chloranyl-2-piperidin-1-yl-phenyl)-4-(4-fluorophenyl)sulfanyl-3-nitro-benzamide

Systemtic Name: N-(5-chloranyl-2-piperidin-1-yl-phenyl)-4-(4-fluorophenyl)sulfanyl-3-nitro-benzamide Openeye Name: N-[5-chloro-2-(1-piperidyl)phenyl]-4-(4-fluorophenyl)sulfanyl-3-nitro-benzamide CAS Name: N-[5-chloro-2-(1-piperidinyl)phenyl]-4-[(4-fluorophenyl)thio]-3-nitrobenzamide IUPAC Name: N-(5-chloro-2-piperidin-1-ylphenyl)-4-(4-fluorophenyl)sulfanyl-3-nitrobenzamide Traditional Name: N-(5-chloro-2-piperidino-phenyl)-4-[(4-fluorophenyl)thio]-3-nitro-benzamide Formula: C24H21ClFN3O3S MolecularWeight: 485.958243

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=CC(=C(C=C3)SC4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=CC(=C(C=C3)SC4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C24H21ClFN3O3S/c25-17-5-10-21(28-12-2-1-3-13-28)20(15-17)27-24(30)16-4-11-23(22(14-16)29(31)32)33-19-8-6-18(26)7-9-19/h4-11,14-15H,1-3,12-13H2,(H,27,30)