6-methyl-2-[1-[(4-methylsulfonylphenyl)methyl]piperidin-4-yl]-1H-benzimidazole

Systemtic Name: 6-methyl-2-[1-[(4-methylsulfonylphenyl)methyl]piperidin-4-yl]-1H-benzimidazole Openeye Name: 6-methyl-2-[1-[(4-methylsulfonylphenyl)methyl]-4-piperidyl]-1H-benzimidazole CAS Name: 6-methyl-2-[1-[(4-methylsulfonylphenyl)methyl]-4-piperidinyl]-1H-benzimidazole IUPAC Name: 6-methyl-2-[1-[(4-methylsulfonylphenyl)methyl]piperidin-4-yl]-1H-benzimidazole Traditional Name: 2-[1-(4-mesylbenzyl)-4-piperidyl]-6-methyl-1H-benzimidazole Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C3CCN(CC3)CC4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)C3CCN(CC3)CC4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C21H25N3O2S/c1-15-3-8-19-20(13-15)23-21(22-19)17-9-11-24(12-10-17)14-16-4-6-18(7-5-16)27(2,25)26/h3-8,13,17H,9-12,14H2,1-2H3,(H,22,23)