4-(2-methoxyphenyl)-2-methyl-1-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]piperazine

Systemtic Name: 4-(2-methoxyphenyl)-2-methyl-1-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]piperazine Openeye Name: 1-[(3-isobutyl-2-methylsulfonyl-imidazol-4-yl)methyl]-4-(2-methoxyphenyl)-2-methyl-piperazine CAS Name: 4-(2-methoxyphenyl)-2-methyl-1-[[3-(2-methylpropyl)-2-methylsulfonyl-4-imidazolyl]methyl]piperazine IUPAC Name: 4-(2-methoxyphenyl)-2-methyl-1-[[3-(2-methylpropyl)-2-methylsulfonylimidazol-4-yl]methyl]piperazine Traditional Name: 1-[(3-isobutyl-2-mesyl-imidazol-4-yl)methyl]-4-(2-methoxyphenyl)-2-methyl-piperazine Formula: C21H32N4O3S MolecularWeight: 420.56878

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC2=CN=C(N2CC(C)C)S(=O)(=O)C)C3=CC=CC=C3OC

Isomeric SMILES

CC1CN(CCN1CC2=CN=C(N2CC(C)C)S(=O)(=O)C)C3=CC=CC=C3OC

InChI

InChI=1S/C21H32N4O3S/c1-16(2)13-25-18(12-22-21(25)29(5,26)27)15-23-10-11-24(14-17(23)3)19-8-6-7-9-20(19)28-4/h6-9,12,16-17H,10-11,13-15H2,1-5H3