2-[4-(5-fluoranyl-2-methoxy-phenyl)sulfonylpiperazin-1-yl]-1-(phenylmethyl)benzimidazole

Systemtic Name: 2-[4-(5-fluoranyl-2-methoxy-phenyl)sulfonylpiperazin-1-yl]-1-(phenylmethyl)benzimidazole Openeye Name: 1-benzyl-2-[4-(5-fluoro-2-methoxy-phenyl)sulfonylpiperazin-1-yl]benzimidazole CAS Name: 2-[4-(5-fluoro-2-methoxyphenyl)sulfonyl-1-piperazinyl]-1-(phenylmethyl)benzimidazole IUPAC Name: 1-benzyl-2-[4-(5-fluoro-2-methoxyphenyl)sulfonylpiperazin-1-yl]benzimidazole Traditional Name: 1-benzyl-2-[4-(5-fluoro-2-methoxy-phenyl)sulfonylpiperazino]benzimidazole Formula: C25H25FN4O3S MolecularWeight: 480.554403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)S(=O)(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3CC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C(C=C1)F)S(=O)(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3CC5=CC=CC=C5

InChI

InChI=1S/C25H25FN4O3S/c1-33-23-12-11-20(26)17-24(23)34(31,32)29-15-13-28(14-16-29)25-27-21-9-5-6-10-22(21)30(25)18-19-7-3-2-4-8-19/h2-12,17H,13-16,18H2,1H3