3-[[5-(3,5-dimethylphenyl)sulfanyl-1-ethoxy-2-methyl-4-propan-2-yl-cycloheptyl]oxymethyl]-1,2-dihydroimidazole

Systemtic Name: 3-[[5-(3,5-dimethylphenyl)sulfanyl-1-ethoxy-2-methyl-4-propan-2-yl-cycloheptyl]oxymethyl]-1,2-dihydroimidazole Openeye Name: 3-[[5-(3,5-dimethylphenyl)sulfanyl-1-ethoxy-4-isopropyl-2-methyl-cycloheptoxy]methyl]-1,2-dihydroimidazole CAS Name: 3-[[5-[(3,5-dimethylphenyl)thio]-1-ethoxy-2-methyl-4-propan-2-ylcycloheptyl]oxymethyl]-1,2-dihydroimidazole IUPAC Name: 3-[[5-(3,5-dimethylphenyl)sulfanyl-1-ethoxy-2-methyl-4-propan-2-ylcycloheptyl]oxymethyl]-1,2-dihydroimidazole Traditional Name: 1-[[5-[(3,5-dimethylphenyl)thio]-1-ethoxy-4-isopropyl-2-methyl-cycloheptoxy]methyl]-4-imidazoline Formula: C25H40N2O2S MolecularWeight: 432.6623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(CCC(C(CC1C)C(C)C)SC2=CC(=CC(=C2)C)C)OCN3CNC=C3

Isomeric SMILES

CCOC1(CCC(C(CC1C)C(C)C)SC2=CC(=CC(=C2)C)C)OCN3CNC=C3

InChI

InChI=1S/C25H40N2O2S/c1-7-28-25(29-17-27-11-10-26-16-27)9-8-24(23(18(2)3)15-21(25)6)30-22-13-19(4)12-20(5)14-22/h10-14,18,21,23-24,26H,7-9,15-17H2,1-6H3