4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-(1-phenylethylcarbamoylamino)benzamide

Systemtic Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-(1-phenylethylcarbamoylamino)benzamide Openeye Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-(1-phenylethylcarbamoylamino)benzamide CAS Name: 4-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-3-[[oxo-(1-phenylethylamino)methyl]amino]benzamide IUPAC Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-(1-phenylethylcarbamoylamino)benzamide Traditional Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazino]-3-(1-phenylethylcarbamoylamino)benzamide Formula: C33H33F2N5O2 MolecularWeight: 569.644226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)NC2=C(C=CC(=C2)C(=O)N)N3CCN(CC3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)NC2=C(C=CC(=C2)C(=O)N)N3CCN(CC3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C33H33F2N5O2/c1-22(23-5-3-2-4-6-23)37-33(42)38-29-21-26(32(36)41)11-16-30(29)39-17-19-40(20-18-39)31(24-7-12-27(34)13-8-24)25-9-14-28(35)15-10-25/h2-16,21-22,31H,17-20H2,1H3,(H2,36,41)(H2,37,38,42)