(3-imidazo[2,1-b][1,3]benzothiazol-2-ylphenyl) 3-azanylpropanoate dihydrochloride

Systemtic Name: (3-imidazo[2,1-b][1,3]benzothiazol-2-ylphenyl) 3-azanylpropanoate dihydrochloride Openeye Name: (3-imidazo[2,1-b][1,3]benzothiazol-2-ylphenyl) 3-aminopropanoate dihydrochloride CAS Name: 3-aminopropanoic acid [3-(2-imidazo[2,1-b][1,3]benzothiazolyl)phenyl] ester dihydrochloride IUPAC Name: (3-imidazo[2,1-b][1,3]benzothiazol-2-ylphenyl) 3-aminopropanoate dihydrochloride Traditional Name: 3-aminopropionic acid (3-imidazo[2,1-b][1,3]benzothiazol-2-ylphenyl) ester dihydrochloride Formula: C18H17Cl2N3O2S MolecularWeight: 410.31748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N3C=C(N=C3S2)C4=CC(=CC=C4)OC(=O)CCN.Cl.Cl

Isomeric SMILES

C1=CC=C2C(=C1)N3C=C(N=C3S2)C4=CC(=CC=C4)OC(=O)CCN.Cl.Cl

InChI

InChI=1S/C18H15N3O2S.2ClH/c19-9-8-17(22)23-13-5-3-4-12(10-13)14-11-21-15-6-1-2-7-16(15)24-18(21)20-14;;/h1-7,10-11H,8-9,19H2;2*1H