2-[1-(4-methoxyphenyl)sulfonyl-4-(phenylmethyl)piperazin-2-yl]-1H-benzimidazole

Systemtic Name: 2-[1-(4-methoxyphenyl)sulfonyl-4-(phenylmethyl)piperazin-2-yl]-1H-benzimidazole Openeye Name: 2-[4-benzyl-1-(4-methoxyphenyl)sulfonyl-piperazin-2-yl]-1H-benzimidazole CAS Name: 2-[1-(4-methoxyphenyl)sulfonyl-4-(phenylmethyl)-2-piperazinyl]-1H-benzimidazole IUPAC Name: 2-[4-benzyl-1-(4-methoxyphenyl)sulfonylpiperazin-2-yl]-1H-benzimidazole Traditional Name: 2-[4-benzyl-1-(4-methoxyphenyl)sulfonyl-piperazin-2-yl]-1H-benzimidazole Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C3=NC4=CC=CC=C4N3)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C3=NC4=CC=CC=C4N3)CC5=CC=CC=C5

InChI

InChI=1S/C25H26N4O3S/c1-32-20-11-13-21(14-12-20)33(30,31)29-16-15-28(17-19-7-3-2-4-8-19)18-24(29)25-26-22-9-5-6-10-23(22)27-25/h2-14,24H,15-18H2,1H3,(H,26,27)