N-[4-[4-(3-fluoranyl-5-methoxy-phenyl)piperazin-1-yl]butyl]-4-imidazol-1-yl-benzamide

Systemtic Name: N-[4-[4-(3-fluoranyl-5-methoxy-phenyl)piperazin-1-yl]butyl]-4-imidazol-1-yl-benzamide Openeye Name: N-[4-[4-(3-fluoro-5-methoxy-phenyl)piperazin-1-yl]butyl]-4-imidazol-1-yl-benzamide CAS Name: N-[4-[4-(3-fluoro-5-methoxyphenyl)-1-piperazinyl]butyl]-4-(1-imidazolyl)benzamide IUPAC Name: N-[4-[4-(3-fluoro-5-methoxyphenyl)piperazin-1-yl]butyl]-4-imidazol-1-ylbenzamide Traditional Name: N-[4-[4-(3-fluoro-5-methoxy-phenyl)piperazino]butyl]-4-imidazol-1-yl-benzamide Formula: C25H30FN5O2 MolecularWeight: 451.536403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2CCN(CC2)CCCCNC(=O)C3=CC=C(C=C3)N4C=CN=C4)F

Isomeric SMILES

COC1=CC(=CC(=C1)N2CCN(CC2)CCCCNC(=O)C3=CC=C(C=C3)N4C=CN=C4)F

InChI

InChI=1S/C25H30FN5O2/c1-33-24-17-21(26)16-23(18-24)30-14-12-29(13-15-30)10-3-2-8-28-25(32)20-4-6-22(7-5-20)31-11-9-27-19-31/h4-7,9,11,16-19H,2-3,8,10,12-15H2,1H3,(H,28,32)