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

Systemtic Name: 4-[4-[5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]piperazin-1-yl]benzenecarbonitrile trihydrochloride Openeye Name: 4-[4-[5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]piperazin-1-yl]benzonitrile trihydrochloride CAS Name: 4-[4-[5-[oxo(3-thiazolidinyl)methyl]-3-pyrrolidinyl]-1-piperazinyl]benzonitrile trihydrochloride IUPAC Name: 4-[4-[5-(1,3-thiazolidine-3-carbonyl)pyrrolidin-3-yl]piperazin-1-yl]benzonitrile trihydrochloride Traditional Name: 4-[4-[5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]piperazino]benzonitrile trihydrochloride Formula: C19H28Cl3N5OS MolecularWeight: 480.88252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N5OS.3ClH/c20-12-15-1-3-16(4-2-15)22-5-7-23(8-6-22)17-11-18(21-13-17)19(25)24-9-10-26-14-24;;;/h1-4,17-18,21H,5-11,13-14H2;3*1H