N-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-1-(3-fluorophenyl)-N-methyl-methanamine

Systemtic Name: N-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-1-(3-fluorophenyl)-N-methyl-methanamine Openeye Name: N-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl]-1-(3-fluorophenyl)-N-methyl-methanamine CAS Name: N-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl]-1-(3-fluorophenyl)-N-methylmethanamine IUPAC Name: N-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl]-1-(3-fluorophenyl)-N-methylmethanamine Traditional Name: (1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl-(3-fluorobenzyl)-methyl-amine Formula: C23H29FN4O2S MolecularWeight: 444.565363

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN(C)CC4=CC(=CC=C4)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN(C)CC4=CC(=CC=C4)F

InChI

InChI=1S/C23H29FN4O2S/c1-3-28-22-11-10-20(31(29,30)27-12-5-4-6-13-27)15-21(22)25-23(28)17-26(2)16-18-8-7-9-19(24)14-18/h7-11,14-15H,3-6,12-13,16-17H2,1-2H3