N-[4-[4-(diphenylmethyl)piperazin-1-yl]-3-fluoranyl-phenyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[4-[4-(diphenylmethyl)piperazin-1-yl]-3-fluoranyl-phenyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Openeye Name: N-[4-(4-benzhydrylpiperazin-1-yl)-3-fluoro-phenyl]-3,5-dimethyl-isoxazole-4-carboxamide CAS Name: N-[4-[4-(diphenylmethyl)-1-piperazinyl]-3-fluorophenyl]-3,5-dimethyl-4-isoxazolecarboxamide IUPAC Name: N-[4-(4-benzhydrylpiperazin-1-yl)-3-fluorophenyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Traditional Name: N-[4-(4-benzhydrylpiperazino)-3-fluoro-phenyl]-3,5-dimethyl-isoxazole-4-carboxamide Formula: C29H29FN4O2 MolecularWeight: 484.564563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)F

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)F

InChI

InChI=1S/C29H29FN4O2/c1-20-27(21(2)36-32-20)29(35)31-24-13-14-26(25(30)19-24)33-15-17-34(18-16-33)28(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-14,19,28H,15-18H2,1-2H3,(H,31,35)