4-[3-(methylamino)pyrrolidin-1-yl]-6-(3-methylphenyl)pyrimidin-2-amine trihydrochloride

Systemtic Name: 4-[3-(methylamino)pyrrolidin-1-yl]-6-(3-methylphenyl)pyrimidin-2-amine trihydrochloride Openeye Name: 4-[3-(methylamino)pyrrolidin-1-yl]-6-(m-tolyl)pyrimidin-2-amine trihydrochloride CAS Name: 4-[3-(methylamino)-1-pyrrolidinyl]-6-(3-methylphenyl)-2-pyrimidinamine trihydrochloride IUPAC Name: 4-[3-(methylamino)pyrrolidin-1-yl]-6-(3-methylphenyl)pyrimidin-2-amine trihydrochloride Traditional Name: [1-[2-amino-6-(m-tolyl)pyrimidin-4-yl]pyrrolidin-3-yl]-methyl-amine trihydrochloride Formula: C16H24Cl3N5 MolecularWeight: 392.75426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC(=NC(=N2)N)N3CCC(C3)NC.Cl.Cl.Cl

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC(=NC(=N2)N)N3CCC(C3)NC.Cl.Cl.Cl

InChI

InChI=1S/C16H21N5.3ClH/c1-11-4-3-5-12(8-11)14-9-15(20-16(17)19-14)21-7-6-13(10-21)18-2;;;/h3-5,8-9,13,18H,6-7,10H2,1-2H3,(H2,17,19,20);3*1H