3-methyl-6-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-1,3-benzothiazol-2-one dihydrochloride

Systemtic Name: 3-methyl-6-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-1,3-benzothiazol-2-one dihydrochloride Openeye Name: 6-[2-(4-benzylpiperazin-1-yl)ethyl]-3-methyl-1,3-benzothiazol-2-one dihydrochloride CAS Name: 3-methyl-6-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-1,3-benzothiazol-2-one dihydrochloride IUPAC Name: 6-[2-(4-benzylpiperazin-1-yl)ethyl]-3-methyl-1,3-benzothiazol-2-one dihydrochloride Traditional Name: 6-[2-(4-benzylpiperazino)ethyl]-3-methyl-1,3-benzothiazol-2-one dihydrochloride Formula: C21H27Cl2N3OS MolecularWeight: 440.42958

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)CCN3CCN(CC3)CC4=CC=CC=C4)SC1=O.Cl.Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2)CCN3CCN(CC3)CC4=CC=CC=C4)SC1=O.Cl.Cl

InChI

InChI=1S/C21H25N3OS.2ClH/c1-22-19-8-7-17(15-20(19)26-21(22)25)9-10-23-11-13-24(14-12-23)16-18-5-3-2-4-6-18;;/h2-8,15H,9-14,16H2,1H3;2*1H