2-[1-[4-[(2S)-2-ethylpiperidin-1-yl]sulfonylphenyl]sulfonylpiperidin-4-yl]-1H-benzimidazole

Systemtic Name: 2-[1-[4-[(2S)-2-ethylpiperidin-1-yl]sulfonylphenyl]sulfonylpiperidin-4-yl]-1H-benzimidazole Openeye Name: 2-[1-[4-[[(2S)-2-ethyl-1-piperidyl]sulfonyl]phenyl]sulfonyl-4-piperidyl]-1H-benzimidazole CAS Name: 2-[1-[4-[[(2S)-2-ethyl-1-piperidinyl]sulfonyl]phenyl]sulfonyl-4-piperidinyl]-1H-benzimidazole IUPAC Name: 2-[1-[4-[(2S)-2-ethylpiperidin-1-yl]sulfonylphenyl]sulfonylpiperidin-4-yl]-1H-benzimidazole Traditional Name: 2-[1-[4-[(2S)-2-ethylpiperidino]sulfonylphenyl]sulfonyl-4-piperidyl]-1H-benzimidazole Formula: C25H32N4O4S2 MolecularWeight: 516.67598

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

CC[C@H]1CCCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C25H32N4O4S2/c1-2-20-7-5-6-16-29(20)35(32,33)22-12-10-21(11-13-22)34(30,31)28-17-14-19(15-18-28)25-26-23-8-3-4-9-24(23)27-25/h3-4,8-13,19-20H,2,5-7,14-18H2,1H3,(H,26,27)/t20-/m0/s1