4-[2-[6-(azepan-1-yl)pyridin-3-yl]ethynyl]-2-methyl-1,3-thiazole hydrochloride

Systemtic Name: 4-[2-[6-(azepan-1-yl)pyridin-3-yl]ethynyl]-2-methyl-1,3-thiazole hydrochloride Openeye Name: 4-[2-[6-(azepan-1-yl)-3-pyridyl]ethynyl]-2-methyl-thiazole hydrochloride CAS Name: 4-[2-[6-(1-azepanyl)-3-pyridinyl]ethynyl]-2-methylthiazole hydrochloride IUPAC Name: 4-[2-[6-(azepan-1-yl)pyridin-3-yl]ethynyl]-2-methyl-1,3-thiazole hydrochloride Traditional Name: 4-[2-[6-(azepan-1-yl)-3-pyridyl]ethynyl]-2-methyl-thiazole hydrochloride Formula: C17H20ClN3S MolecularWeight: 333.8788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C#CC2=CN=C(C=C2)N3CCCCCC3.Cl

Isomeric SMILES

CC1=NC(=CS1)C#CC2=CN=C(C=C2)N3CCCCCC3.Cl

InChI

InChI=1S/C17H19N3S.ClH/c1-14-19-16(13-21-14)8-6-15-7-9-17(18-12-15)20-10-4-2-3-5-11-20;/h7,9,12-13H,2-5,10-11H2,1H3;1H