1-butyl-2-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[[(3R,5S)-3,5-dimethyl-1-piperidyl]methyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[(3R,5S)-3,5-dimethyl-1-piperidinyl]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[(3R,5S)-3,5-dimethylpiperidino]methyl]benzimidazole-5-sulfonamide Formula: C19H30N4O2S MolecularWeight: 378.5321

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN3CC(CC(C3)C)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN3C[C@@H](C[C@@H](C3)C)C

InChI

InChI=1S/C19H30N4O2S/c1-4-5-8-23-18-7-6-16(26(20,24)25)10-17(18)21-19(23)13-22-11-14(2)9-15(3)12-22/h6-7,10,14-15H,4-5,8-9,11-13H2,1-3H3,(H2,20,24,25)/t14-,15+