N-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]-2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine

Systemtic Name: N-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]-2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine Openeye Name: N-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]-2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine CAS Name: N-[(3-butyl-2-ethylsulfonyl-4-imidazolyl)methyl]-2-(3,4-dimethoxyphenyl)-N-methylethanamine IUPAC Name: N-[(3-butyl-2-ethylsulfonylimidazol-4-yl)methyl]-2-(3,4-dimethoxyphenyl)-N-methylethanamine Traditional Name: (3-butyl-2-esyl-imidazol-4-yl)methyl-homoveratryl-methyl-amine Formula: C21H33N3O4S MolecularWeight: 423.56942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC)CN(C)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC)CN(C)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H33N3O4S/c1-6-8-12-24-18(15-22-21(24)29(25,26)7-2)16-23(3)13-11-17-9-10-19(27-4)20(14-17)28-5/h9-10,14-15H,6-8,11-13,16H2,1-5H3