3-[5-[3,5-bis(fluoranyl)phenyl]sulfanyl-1-hexyl-4-propan-2-yl-imidazol-2-yl]propyl carbamate

Systemtic Name: 3-[5-[3,5-bis(fluoranyl)phenyl]sulfanyl-1-hexyl-4-propan-2-yl-imidazol-2-yl]propyl carbamate Openeye Name: 3-[5-(3,5-difluorophenyl)sulfanyl-1-hexyl-4-isopropyl-imidazol-2-yl]propyl carbamate CAS Name: carbamic acid 3-[5-[(3,5-difluorophenyl)thio]-1-hexyl-4-propan-2-yl-2-imidazolyl]propyl ester IUPAC Name: 3-[5-(3,5-difluorophenyl)sulfanyl-1-hexyl-4-propan-2-ylimidazol-2-yl]propyl carbamate Traditional Name: carbamic acid 3-[5-[(3,5-difluorophenyl)thio]-1-hexyl-4-isopropyl-imidazol-2-yl]propyl ester Formula: C22H31F2N3O2S MolecularWeight: 439.562246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=NC(=C1SC2=CC(=CC(=C2)F)F)C(C)C)CCCOC(=O)N

Isomeric SMILES

CCCCCCN1C(=NC(=C1SC2=CC(=CC(=C2)F)F)C(C)C)CCCOC(=O)N

InChI

InChI=1S/C22H31F2N3O2S/c1-4-5-6-7-10-27-19(9-8-11-29-22(25)28)26-20(15(2)3)21(27)30-18-13-16(23)12-17(24)14-18/h12-15H,4-11H2,1-3H3,(H2,25,28)