N-(2,5-dimethylphenyl)-2-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-2-phenyl-ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-2-phenyl-ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-2-phenyl-acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-2-phenylacetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-2-phenylacetamide Traditional Name: N-(2,5-dimethylphenyl)-2-[4-(4-fluorobenzoyl)piperazino]-2-phenyl-acetamide Formula: C27H28FN3O2 MolecularWeight: 445.528523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H28FN3O2/c1-19-8-9-20(2)24(18-19)29-26(32)25(21-6-4-3-5-7-21)30-14-16-31(17-15-30)27(33)22-10-12-23(28)13-11-22/h3-13,18,25H,14-17H2,1-2H3,(H,29,32)