N-(3-chloranyl-4-methyl-phenyl)-5-[4-(2-fluorophenyl)piperazin-1-yl]-5-oxidanylidene-pentanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-5-[4-(2-fluorophenyl)piperazin-1-yl]-5-oxidanylidene-pentanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-5-[4-(2-fluorophenyl)piperazin-1-yl]-5-oxo-pentanamide CAS Name: N-(3-chloro-4-methylphenyl)-5-[4-(2-fluorophenyl)-1-piperazinyl]-5-oxopentanamide IUPAC Name: N-(3-chloro-4-methylphenyl)-5-[4-(2-fluorophenyl)piperazin-1-yl]-5-oxopentanamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-5-[4-(2-fluorophenyl)piperazino]-5-keto-valeramide Formula: C22H25ClFN3O2 MolecularWeight: 417.904203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCCC(=O)N2CCN(CC2)C3=CC=CC=C3F)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCCC(=O)N2CCN(CC2)C3=CC=CC=C3F)Cl

InChI

InChI=1S/C22H25ClFN3O2/c1-16-9-10-17(15-18(16)23)25-21(28)7-4-8-22(29)27-13-11-26(12-14-27)20-6-3-2-5-19(20)24/h2-3,5-6,9-10,15H,4,7-8,11-14H2,1H3,(H,25,28)