N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-2-phenethyl-1,3-benzoxazole-6-carboxamide

Systemtic Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-2-phenethyl-1,3-benzoxazole-6-carboxamide Openeye Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-2-phenethyl-1,3-benzoxazole-6-carboxamide CAS Name: N-[3-[4-(2-fluorophenyl)-1-piperazinyl]propyl]-2-phenethyl-1,3-benzoxazole-6-carboxamide IUPAC Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-2-phenethyl-1,3-benzoxazole-6-carboxamide Traditional Name: N-[3-[4-(2-fluorophenyl)piperazino]propyl]-2-phenethyl-1,3-benzoxazole-6-carboxamide Formula: C29H31FN4O2 MolecularWeight: 486.580443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C2=CC3=C(C=C2)N=C(O3)CCC4=CC=CC=C4)C5=CC=CC=C5F

Isomeric SMILES

C1CN(CCN1CCCNC(=O)C2=CC3=C(C=C2)N=C(O3)CCC4=CC=CC=C4)C5=CC=CC=C5F

InChI

InChI=1S/C29H31FN4O2/c30-24-9-4-5-10-26(24)34-19-17-33(18-20-34)16-6-15-31-29(35)23-12-13-25-27(21-23)36-28(32-25)14-11-22-7-2-1-3-8-22/h1-5,7-10,12-13,21H,6,11,14-20H2,(H,31,35)