piperazin-1-yl-[1-[6-(2-piperazin-1-ylcarbonylpiperazin-1-yl)carbonylpyridin-2-yl]carbonylpiperazin-2-yl]methanone trihydrochloride

Systemtic Name: piperazin-1-yl-[1-[6-(2-piperazin-1-ylcarbonylpiperazin-1-yl)carbonylpyridin-2-yl]carbonylpiperazin-2-yl]methanone trihydrochloride Openeye Name: [1-[6-[2-(piperazine-1-carbonyl)piperazine-1-carbonyl]pyridine-2-carbonyl]piperazin-2-yl]-piperazin-1-yl-methanone trihydrochloride CAS Name: [1-[oxo-[6-[oxo-[2-[oxo(1-piperazinyl)methyl]-1-piperazinyl]methyl]-2-pyridinyl]methyl]-2-piperazinyl]-(1-piperazinyl)methanone trihydrochloride IUPAC Name: [1-[6-[2-(piperazine-1-carbonyl)piperazine-1-carbonyl]pyridine-2-carbonyl]piperazin-2-yl]-piperazin-1-ylmethanone trihydrochloride Traditional Name: [1-[6-[2-(piperazine-1-carbonyl)piperazine-1-carbonyl]picolinoyl]piperazin-2-yl]-piperazino-methanone trihydrochloride Formula: C25H40Cl3N9O4 MolecularWeight: 637.002

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2CNCCN2C(=O)C3=NC(=CC=C3)C(=O)N4CCNCC4C(=O)N5CCNCC5.Cl.Cl.Cl

Isomeric SMILES

C1CN(CCN1)C(=O)C2CNCCN2C(=O)C3=NC(=CC=C3)C(=O)N4CCNCC4C(=O)N5CCNCC5.Cl.Cl.Cl

InChI

InChI=1S/C25H37N9O4.3ClH/c35-22(33-14-8-28-16-20(33)24(37)31-10-4-26-5-11-31)18-2-1-3-19(30-18)23(36)34-15-9-29-17-21(34)25(38)32-12-6-27-7-13-32;;;/h1-3,20-21,26-29H,4-17H2;3*1H