N-[(2-ethylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-N-(pyridin-4-ylmethyl)ethanamine

Systemtic Name: N-[(2-ethylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-N-(pyridin-4-ylmethyl)ethanamine Openeye Name: N-[(2-ethylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-N-(4-pyridylmethyl)ethanamine CAS Name: N-[(2-ethylsulfonyl-3-phenethyl-4-imidazolyl)methyl]-N-(pyridin-4-ylmethyl)ethanamine IUPAC Name: N-[(2-ethylsulfonyl-3-phenethylimidazol-4-yl)methyl]-N-(pyridin-4-ylmethyl)ethanamine Traditional Name: (2-esyl-3-phenethyl-imidazol-4-yl)methyl-ethyl-(4-pyridylmethyl)amine Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)CC2=CN=C(N2CCC3=CC=CC=C3)S(=O)(=O)CC

Isomeric SMILES

CCN(CC1=CC=NC=C1)CC2=CN=C(N2CCC3=CC=CC=C3)S(=O)(=O)CC

InChI

InChI=1S/C22H28N4O2S/c1-3-25(17-20-10-13-23-14-11-20)18-21-16-24-22(29(27,28)4-2)26(21)15-12-19-8-6-5-7-9-19/h5-11,13-14,16H,3-4,12,15,17-18H2,1-2H3