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

Systemtic Name: 2-[4-[5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]piperazin-1-yl]-3H-benzimidazole-5-carbonitrile trihydrochloride Openeye Name: 2-[4-[5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]piperazin-1-yl]-3H-benzimidazole-5-carbonitrile trihydrochloride CAS Name: 2-[4-[5-[oxo(3-thiazolidinyl)methyl]-3-pyrrolidinyl]-1-piperazinyl]-3H-benzimidazole-5-carbonitrile trihydrochloride IUPAC Name: 2-[4-[5-(1,3-thiazolidine-3-carbonyl)pyrrolidin-3-yl]piperazin-1-yl]-3H-benzimidazole-5-carbonitrile trihydrochloride Traditional Name: 2-[4-[5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]piperazino]-3H-benzimidazole-5-carbonitrile trihydrochloride Formula: C20H28Cl3N7OS MolecularWeight: 520.90662

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2CC(NC2)C(=O)N3CCSC3)C4=NC5=C(N4)C=C(C=C5)C#N.Cl.Cl.Cl

Isomeric SMILES

C1CN(CCN1C2CC(NC2)C(=O)N3CCSC3)C4=NC5=C(N4)C=C(C=C5)C#N.Cl.Cl.Cl

InChI

InChI=1S/C20H25N7OS.3ClH/c21-11-14-1-2-16-17(9-14)24-20(23-16)26-5-3-25(4-6-26)15-10-18(22-12-15)19(28)27-7-8-29-13-27;;;/h1-2,9,15,18,22H,3-8,10,12-13H2,(H,23,24);3*1H