4-[2-[5-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]carbonyl-1-methyl-benzimidazol-2-yl]ethyl]benzenecarboximidamide

Systemtic Name: 4-[2-[5-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]carbonyl-1-methyl-benzimidazol-2-yl]ethyl]benzenecarboximidamide Openeye Name: 4-[2-[5-[4-(4-fluorobenzoyl)piperazine-1-carbonyl]-1-methyl-benzimidazol-2-yl]ethyl]benzamidine CAS Name: 4-[2-[5-[[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-1-methyl-2-benzimidazolyl]ethyl]benzenecarboximidamide IUPAC Name: 4-[2-[5-[4-(4-fluorobenzoyl)piperazine-1-carbonyl]-1-methylbenzimidazol-2-yl]ethyl]benzenecarboximidamide Traditional Name: 4-[2-[5-[4-(4-fluorobenzoyl)piperazine-1-carbonyl]-1-methyl-benzimidazol-2-yl]ethyl]benzamidine Formula: C29H29FN6O2 MolecularWeight: 512.577963

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)F)N=C1CCC5=CC=C(C=C5)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)F)N=C1CCC5=CC=C(C=C5)C(=N)N

InChI

InChI=1S/C29H29FN6O2/c1-34-25-12-9-22(18-24(25)33-26(34)13-4-19-2-5-20(6-3-19)27(31)32)29(38)36-16-14-35(15-17-36)28(37)21-7-10-23(30)11-8-21/h2-3,5-12,18H,4,13-17H2,1H3,(H3,31,32)