2-(5-azanylhexan-3-ylsulfanyl)-1,3-benzothiazol-6-amine hydrochloride

Systemtic Name: 2-(5-azanylhexan-3-ylsulfanyl)-1,3-benzothiazol-6-amine hydrochloride Openeye Name: 2-(3-amino-1-ethyl-butyl)sulfanyl-1,3-benzothiazol-6-amine hydrochloride CAS Name: 2-(5-aminohexan-3-ylthio)-1,3-benzothiazol-6-amine hydrochloride IUPAC Name: 2-(5-aminohexan-3-ylsulfanyl)-1,3-benzothiazol-6-amine hydrochloride Traditional Name: [3-[(6-amino-1,3-benzothiazol-2-yl)thio]-1-methyl-pentyl]amine hydrochloride Formula: C13H20ClN3S2 MolecularWeight: 317.901

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)N)SC1=NC2=C(S1)C=C(C=C2)N.Cl

Isomeric SMILES

CCC(CC(C)N)SC1=NC2=C(S1)C=C(C=C2)N.Cl

InChI

InChI=1S/C13H19N3S2.ClH/c1-3-10(6-8(2)14)17-13-16-11-5-4-9(15)7-12(11)18-13;/h4-5,7-8,10H,3,6,14-15H2,1-2H3;1H