2-[4-(hexylsulfonylmethyl)phenyl]-N-[3-(1H-imidazol-2-yl)propyl]propan-2-amine

Systemtic Name: 2-[4-(hexylsulfonylmethyl)phenyl]-N-[3-(1H-imidazol-2-yl)propyl]propan-2-amine Openeye Name: 2-[4-(hexylsulfonylmethyl)phenyl]-N-[3-(1H-imidazol-2-yl)propyl]propan-2-amine CAS Name: 2-[4-(hexylsulfonylmethyl)phenyl]-N-[3-(1H-imidazol-2-yl)propyl]-2-propanamine IUPAC Name: 2-[4-(hexylsulfonylmethyl)phenyl]-N-[3-(1H-imidazol-2-yl)propyl]propan-2-amine Traditional Name: [1-[4-(hexylsulfonylmethyl)phenyl]-1-methyl-ethyl]-[3-(1H-imidazol-2-yl)propyl]amine Formula: C22H35N3O2S MolecularWeight: 405.5972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)CC1=CC=C(C=C1)C(C)(C)NCCCC2=NC=CN2

Isomeric SMILES

CCCCCCS(=O)(=O)CC1=CC=C(C=C1)C(C)(C)NCCCC2=NC=CN2

InChI

InChI=1S/C22H35N3O2S/c1-4-5-6-7-17-28(26,27)18-19-10-12-20(13-11-19)22(2,3)25-14-8-9-21-23-15-16-24-21/h10-13,15-16,25H,4-9,14,17-18H2,1-3H3,(H,23,24)