N,N-bis[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-1-(2-methylphenyl)ethanamine

Systemtic Name: N,N-bis[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-1-(2-methylphenyl)ethanamine Openeye Name: N,N-bis[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl]-1-(o-tolyl)ethanamine CAS Name: N,N-bis[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl]-1-(2-methylphenyl)ethanamine IUPAC Name: N,N-bis[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl]-1-(2-methylphenyl)ethanamine Traditional Name: bis[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl]-[1-(o-tolyl)ethyl]amine Formula: C39H51N7O4S2 MolecularWeight: 745.99674

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN(CC4=NC5=C(N4CC)C=CC(=C5)S(=O)(=O)N6CCCCC6)C(C)C7=CC=CC=C7C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN(CC4=NC5=C(N4CC)C=CC(=C5)S(=O)(=O)N6CCCCC6)C(C)C7=CC=CC=C7C

InChI

InChI=1S/C39H51N7O4S2/c1-5-45-36-19-17-31(51(47,48)43-21-11-7-12-22-43)25-34(36)40-38(45)27-42(30(4)33-16-10-9-15-29(33)3)28-39-41-35-26-32(18-20-37(35)46(39)6-2)52(49,50)44-23-13-8-14-24-44/h9-10,15-20,25-26,30H,5-8,11-14,21-24,27-28H2,1-4H3