3-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-1,3-benzothiazol-2-one dihydrochloride

Systemtic Name: 3-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-1,3-benzothiazol-2-one dihydrochloride Openeye Name: 3-[3-(4-benzhydrylpiperazin-1-yl)propyl]-1,3-benzothiazol-2-one dihydrochloride CAS Name: 3-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-1,3-benzothiazol-2-one dihydrochloride IUPAC Name: 3-[3-(4-benzhydrylpiperazin-1-yl)propyl]-1,3-benzothiazol-2-one dihydrochloride Traditional Name: 3-[3-(4-benzhydrylpiperazino)propyl]-1,3-benzothiazol-2-one dihydrochloride Formula: C27H31Cl2N3OS MolecularWeight: 516.52554

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN2C3=CC=CC=C3SC2=O)C(C4=CC=CC=C4)C5=CC=CC=C5.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCCN2C3=CC=CC=C3SC2=O)C(C4=CC=CC=C4)C5=CC=CC=C5.Cl.Cl

InChI

InChI=1S/C27H29N3OS.2ClH/c31-27-30(24-14-7-8-15-25(24)32-27)17-9-16-28-18-20-29(21-19-28)26(22-10-3-1-4-11-22)23-12-5-2-6-13-23;;/h1-8,10-15,26H,9,16-21H2;2*1H