N-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-2-(4-fluoranylphenoxy)-N-methyl-ethanamine

Systemtic Name: N-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-2-(4-fluoranylphenoxy)-N-methyl-ethanamine Openeye Name: N-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl]-2-(4-fluorophenoxy)-N-methyl-ethanamine CAS Name: N-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl]-2-(4-fluorophenoxy)-N-methylethanamine IUPAC Name: N-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl]-2-(4-fluorophenoxy)-N-methylethanamine Traditional Name: (1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl-[2-(4-fluorophenoxy)ethyl]-methyl-amine Formula: C24H31FN4O3S MolecularWeight: 474.591343

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN(C)CCOC4=CC=C(C=C4)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN(C)CCOC4=CC=C(C=C4)F

InChI

InChI=1S/C24H31FN4O3S/c1-3-29-23-12-11-21(33(30,31)28-13-5-4-6-14-28)17-22(23)26-24(29)18-27(2)15-16-32-20-9-7-19(25)8-10-20/h7-12,17H,3-6,13-16,18H2,1-2H3