2-[4-[5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]piperazin-1-yl]pyridine-4-carbonitrile trihydrochloride

Systemtic Name: 2-[4-[5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]piperazin-1-yl]pyridine-4-carbonitrile trihydrochloride Openeye Name: 2-[4-[5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]piperazin-1-yl]pyridine-4-carbonitrile trihydrochloride CAS Name: 2-[4-[5-[oxo(3-thiazolidinyl)methyl]-3-pyrrolidinyl]-1-piperazinyl]-4-pyridinecarbonitrile trihydrochloride IUPAC Name: 2-[4-[5-(1,3-thiazolidine-3-carbonyl)pyrrolidin-3-yl]piperazin-1-yl]pyridine-4-carbonitrile trihydrochloride Traditional Name: 2-[4-[5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]piperazino]isonicotinonitrile trihydrochloride Formula: C18H27Cl3N6OS MolecularWeight: 481.87058

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2CC(NC2)C(=O)N3CCSC3)C4=NC=CC(=C4)C#N.Cl.Cl.Cl

Isomeric SMILES

C1CN(CCN1C2CC(NC2)C(=O)N3CCSC3)C4=NC=CC(=C4)C#N.Cl.Cl.Cl

InChI

InChI=1S/C18H24N6OS.3ClH/c19-11-14-1-2-20-17(9-14)23-5-3-22(4-6-23)15-10-16(21-12-15)18(25)24-7-8-26-13-24;;;/h1-2,9,15-16,21H,3-8,10,12-13H2;3*1H