N-(4-aminophenyl)-3-(2-methyl-4-pyridin-2-yl-piperazin-1-yl)propanamide trihydrochloride

Systemtic Name: N-(4-aminophenyl)-3-(2-methyl-4-pyridin-2-yl-piperazin-1-yl)propanamide trihydrochloride Openeye Name: N-(4-aminophenyl)-3-[2-methyl-4-(2-pyridyl)piperazin-1-yl]propanamide trihydrochloride CAS Name: N-(4-aminophenyl)-3-[2-methyl-4-(2-pyridinyl)-1-piperazinyl]propanamide trihydrochloride IUPAC Name: N-(4-aminophenyl)-3-(2-methyl-4-pyridin-2-ylpiperazin-1-yl)propanamide trihydrochloride Traditional Name: N-(4-aminophenyl)-3-[2-methyl-4-(2-pyridyl)piperazino]propionamide trihydrochloride Formula: C19H28Cl3N5O MolecularWeight: 448.81752

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CCC(=O)NC2=CC=C(C=C2)N)C3=CC=CC=N3.Cl.Cl.Cl

Isomeric SMILES

CC1CN(CCN1CCC(=O)NC2=CC=C(C=C2)N)C3=CC=CC=N3.Cl.Cl.Cl

InChI

InChI=1S/C19H25N5O.3ClH/c1-15-14-24(18-4-2-3-10-21-18)13-12-23(15)11-9-19(25)22-17-7-5-16(20)6-8-17;;;/h2-8,10,15H,9,11-14,20H2,1H3,(H,22,25);3*1H