4-[3-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[[(1-cyclopentyl-4,5-dimethyl-2-imidazolyl)thio]methyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[(1-cyclopentyl-4,5-dimethylimidazol-2-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)thio]methyl]phenyl]sulfonylmorpholine Formula: C21H29N3O3S2 MolecularWeight: 435.60326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C4CCCC4)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C4CCCC4)C

InChI

InChI=1S/C21H29N3O3S2/c1-16-17(2)24(19-7-3-4-8-19)21(22-16)28-15-18-6-5-9-20(14-18)29(25,26)23-10-12-27-13-11-23/h5-6,9,14,19H,3-4,7-8,10-13,15H2,1-2H3