(1S)-1-(4-methoxyphenyl)-N-methyl-N-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl]ethanamine

Systemtic Name: (1S)-1-(4-methoxyphenyl)-N-methyl-N-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl]ethanamine Openeye Name: (1S)-N-[(3-isopentyl-2-isopropylsulfonyl-imidazol-4-yl)methyl]-1-(4-methoxyphenyl)-N-methyl-ethanamine CAS Name: (1S)-1-(4-methoxyphenyl)-N-methyl-N-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-4-imidazolyl]methyl]ethanamine IUPAC Name: (1S)-1-(4-methoxyphenyl)-N-methyl-N-[[3-(3-methylbutyl)-2-propan-2-ylsulfonylimidazol-4-yl]methyl]ethanamine Traditional Name: (3-isoamyl-2-isopropylsulfonyl-imidazol-4-yl)methyl-[(1S)-1-(4-methoxyphenyl)ethyl]-methyl-amine Formula: C22H35N3O3S MolecularWeight: 421.5966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=CN=C1S(=O)(=O)C(C)C)CN(C)C(C)C2=CC=C(C=C2)OC

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)OC)N(C)CC2=CN=C(N2CCC(C)C)S(=O)(=O)C(C)C

InChI

InChI=1S/C22H35N3O3S/c1-16(2)12-13-25-20(14-23-22(25)29(26,27)17(3)4)15-24(6)18(5)19-8-10-21(28-7)11-9-19/h8-11,14,16-18H,12-13,15H2,1-7H3/t18-/m0/s1