4-(1H-imidazol-5-ylmethoxy)-1-[[1-(4-methylphenyl)sulfonylpyrrol-2-yl]methyl]piperidine

Systemtic Name: 4-(1H-imidazol-5-ylmethoxy)-1-[[1-(4-methylphenyl)sulfonylpyrrol-2-yl]methyl]piperidine Openeye Name: 4-(1H-imidazol-5-ylmethoxy)-1-[[1-(p-tolylsulfonyl)pyrrol-2-yl]methyl]piperidine CAS Name: 4-(1H-imidazol-5-ylmethoxy)-1-[[1-(4-methylphenyl)sulfonyl-2-pyrrolyl]methyl]piperidine IUPAC Name: 4-(1H-imidazol-5-ylmethoxy)-1-[[1-(4-methylphenyl)sulfonylpyrrol-2-yl]methyl]piperidine Traditional Name: 4-(1H-imidazol-5-ylmethoxy)-1-[(1-tosylpyrrol-2-yl)methyl]piperidine Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2CN3CCC(CC3)OCC4=CN=CN4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2CN3CCC(CC3)OCC4=CN=CN4

InChI

InChI=1S/C21H26N4O3S/c1-17-4-6-21(7-5-17)29(26,27)25-10-2-3-19(25)14-24-11-8-20(9-12-24)28-15-18-13-22-16-23-18/h2-7,10,13,16,20H,8-9,11-12,14-15H2,1H3,(H,22,23)