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

Systemtic Name: 2-azanyl-7-ethyl-5-methoxy-4-(pyridin-3-ylmethyl)-1,3-benzothiazol-6-ol dihydrochloride Openeye Name: 2-amino-7-ethyl-5-methoxy-4-(3-pyridylmethyl)-1,3-benzothiazol-6-ol dihydrochloride CAS Name: 2-amino-7-ethyl-5-methoxy-4-(3-pyridinylmethyl)-1,3-benzothiazol-6-ol dihydrochloride IUPAC Name: 2-amino-7-ethyl-5-methoxy-4-(pyridin-3-ylmethyl)-1,3-benzothiazol-6-ol dihydrochloride Traditional Name: 2-amino-7-ethyl-5-methoxy-4-(3-pyridylmethyl)-1,3-benzothiazol-6-ol dihydrochloride Formula: C16H19Cl2N3O2S MolecularWeight: 388.31196

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=C(C(=C1O)OC)CC3=CN=CC=C3)N=C(S2)N.Cl.Cl

Isomeric SMILES

CCC1=C2C(=C(C(=C1O)OC)CC3=CN=CC=C3)N=C(S2)N.Cl.Cl

InChI

InChI=1S/C16H17N3O2S.2ClH/c1-3-10-13(20)14(21-2)11(7-9-5-4-6-18-8-9)12-15(10)22-16(17)19-12;;/h4-6,8,20H,3,7H2,1-2H3,(H2,17,19);2*1H