1-[1-[3-(4-ethylsulfonylpiperazin-1-yl)-3-phenyl-propyl]piperidin-4-yl]-5-methylsulfonyl-benzimidazole

Systemtic Name: 1-[1-[3-(4-ethylsulfonylpiperazin-1-yl)-3-phenyl-propyl]piperidin-4-yl]-5-methylsulfonyl-benzimidazole Openeye Name: 1-[1-[3-(4-ethylsulfonylpiperazin-1-yl)-3-phenyl-propyl]-4-piperidyl]-5-methylsulfonyl-benzimidazole CAS Name: 1-[1-[3-(4-ethylsulfonyl-1-piperazinyl)-3-phenylpropyl]-4-piperidinyl]-5-methylsulfonylbenzimidazole IUPAC Name: 1-[1-[3-(4-ethylsulfonylpiperazin-1-yl)-3-phenylpropyl]piperidin-4-yl]-5-methylsulfonylbenzimidazole Traditional Name: 1-[1-[3-(4-esylpiperazino)-3-phenyl-propyl]-4-piperidyl]-5-mesyl-benzimidazole Formula: C28H39N5O4S2 MolecularWeight: 573.77036

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)C(CCN2CCC(CC2)N3C=NC4=C3C=CC(=C4)S(=O)(=O)C)C5=CC=CC=C5

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)C(CCN2CCC(CC2)N3C=NC4=C3C=CC(=C4)S(=O)(=O)C)C5=CC=CC=C5

InChI

InChI=1S/C28H39N5O4S2/c1-3-39(36,37)32-19-17-31(18-20-32)27(23-7-5-4-6-8-23)13-16-30-14-11-24(12-15-30)33-22-29-26-21-25(38(2,34)35)9-10-28(26)33/h4-10,21-22,24,27H,3,11-20H2,1-2H3