1-[(5-methyl-1,3-benzothiazol-2-yl)sulfanyl]-3-(propan-2-ylamino)propan-2-ol hydrochloride

Systemtic Name: 1-[(5-methyl-1,3-benzothiazol-2-yl)sulfanyl]-3-(propan-2-ylamino)propan-2-ol hydrochloride Openeye Name: 1-(isopropylamino)-3-[(5-methyl-1,3-benzothiazol-2-yl)sulfanyl]propan-2-ol hydrochloride CAS Name: 1-[(5-methyl-1,3-benzothiazol-2-yl)thio]-3-(propan-2-ylamino)-2-propanol hydrochloride IUPAC Name: 1-[(5-methyl-1,3-benzothiazol-2-yl)sulfanyl]-3-(propan-2-ylamino)propan-2-ol hydrochloride Traditional Name: 1-(isopropylamino)-3-[(5-methyl-1,3-benzothiazol-2-yl)thio]propan-2-ol hydrochloride Formula: C14H21ClN2OS2 MolecularWeight: 332.91234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=N2)SCC(CNC(C)C)O.Cl

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=N2)SCC(CNC(C)C)O.Cl

InChI

InChI=1S/C14H20N2OS2.ClH/c1-9(2)15-7-11(17)8-18-14-16-12-6-10(3)4-5-13(12)19-14;/h4-6,9,11,15,17H,7-8H2,1-3H3;1H