2-azanyl-5,7-dimethyl-4-(pyridin-3-ylmethyl)-1,3-benzothiazol-6-ol dihydrochloride

Systemtic Name: 2-azanyl-5,7-dimethyl-4-(pyridin-3-ylmethyl)-1,3-benzothiazol-6-ol dihydrochloride Openeye Name: 2-amino-5,7-dimethyl-4-(3-pyridylmethyl)-1,3-benzothiazol-6-ol dihydrochloride CAS Name: 2-amino-5,7-dimethyl-4-(3-pyridinylmethyl)-1,3-benzothiazol-6-ol dihydrochloride IUPAC Name: 2-amino-5,7-dimethyl-4-(pyridin-3-ylmethyl)-1,3-benzothiazol-6-ol dihydrochloride Traditional Name: 2-amino-5,7-dimethyl-4-(3-pyridylmethyl)-1,3-benzothiazol-6-ol dihydrochloride Formula: C15H17Cl2N3OS MolecularWeight: 358.28598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(=C1O)C)SC(=N2)N)CC3=CN=CC=C3.Cl.Cl

Isomeric SMILES

CC1=C(C2=C(C(=C1O)C)SC(=N2)N)CC3=CN=CC=C3.Cl.Cl

InChI

InChI=1S/C15H15N3OS.2ClH/c1-8-11(6-10-4-3-5-17-7-10)12-14(9(2)13(8)19)20-15(16)18-12;;/h3-5,7,19H,6H2,1-2H3,(H2,16,18);2*1H