2-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]-1H-benzimidazole

Systemtic Name: 2-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]-1H-benzimidazole Openeye Name: 2-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidyl]-1H-benzimidazole CAS Name: 2-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinyl]-1H-benzimidazole IUPAC Name: 2-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]-1H-benzimidazole Traditional Name: 2-(1-mesitylsulfonyl-4-piperidyl)-1H-benzimidazole Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C3=NC4=CC=CC=C4N3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C3=NC4=CC=CC=C4N3)C

InChI

InChI=1S/C21H25N3O2S/c1-14-12-15(2)20(16(3)13-14)27(25,26)24-10-8-17(9-11-24)21-22-18-6-4-5-7-19(18)23-21/h4-7,12-13,17H,8-11H2,1-3H3,(H,22,23)