N-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]-N-methyl-2-phenyl-ethanamine

Systemtic Name: N-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]-N-methyl-2-phenyl-ethanamine Openeye Name: N-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]-N-methyl-2-phenyl-ethanamine CAS Name: N-[[3-butyl-2-(cyclobutylmethylsulfonyl)-4-imidazolyl]methyl]-N-methyl-2-phenylethanamine IUPAC Name: N-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]-N-methyl-2-phenylethanamine Traditional Name: [3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-phenethyl-amine Formula: C22H33N3O2S MolecularWeight: 403.58132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)CN(C)CCC3=CC=CC=C3

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)CN(C)CCC3=CC=CC=C3

InChI

InChI=1S/C22H33N3O2S/c1-3-4-14-25-21(17-24(2)15-13-19-9-6-5-7-10-19)16-23-22(25)28(26,27)18-20-11-8-12-20/h5-7,9-10,16,20H,3-4,8,11-15,17-18H2,1-2H3