4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-7-methyl-1,3-dihydrobenzimidazole-2-thione hydrochloride

Systemtic Name: 4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-7-methyl-1,3-dihydrobenzimidazole-2-thione hydrochloride Openeye Name: 4-[3-(tert-butylamino)-2-hydroxy-propoxy]-7-methyl-1,3-dihydrobenzimidazole-2-thione hydrochloride CAS Name: 4-[3-(tert-butylamino)-2-hydroxypropoxy]-7-methyl-1,3-dihydrobenzimidazole-2-thione hydrochloride IUPAC Name: 4-[3-(tert-butylamino)-2-hydroxypropoxy]-7-methyl-1,3-dihydrobenzimidazole-2-thione hydrochloride Traditional Name: 4-[3-(tert-butylamino)-2-hydroxy-propoxy]-7-methyl-1,3-dihydrobenzimidazole-2-thione hydrochloride Formula: C15H24ClN3O2S MolecularWeight: 345.88796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)OCC(CNC(C)(C)C)O)NC(=S)N2.Cl

Isomeric SMILES

CC1=C2C(=C(C=C1)OCC(CNC(C)(C)C)O)NC(=S)N2.Cl

InChI

InChI=1S/C15H23N3O2S.ClH/c1-9-5-6-11(13-12(9)17-14(21)18-13)20-8-10(19)7-16-15(2,3)4;/h5-6,10,16,19H,7-8H2,1-4H3,(H2,17,18,21);1H