4-chloranyl-6-[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]pyrimidin-2-amine

Systemtic Name: 4-chloranyl-6-[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]pyrimidin-2-amine Openeye Name: 4-chloro-6-[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazin-1-yl]pyrimidin-2-amine CAS Name: 4-chloro-6-[4-(6-methyl-2-propan-2-yl-4-pyrimidin-3-iumyl)-1-piperazinyl]-2-pyrimidinamine IUPAC Name: 4-chloro-6-[4-(6-methyl-2-propan-2-ylpyrimidin-3-ium-4-yl)piperazin-1-yl]pyrimidin-2-amine Traditional Name: [4-chloro-6-[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazino]pyrimidin-2-yl]amine Formula: C16H23ClN7+ MolecularWeight: 348.85372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)C(C)C)N2CCN(CC2)C3=CC(=NC(=N3)N)Cl

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)C(C)C)N2CCN(CC2)C3=CC(=NC(=N3)N)Cl

InChI

InChI=1S/C16H22ClN7/c1-10(2)15-19-11(3)8-13(21-15)23-4-6-24(7-5-23)14-9-12(17)20-16(18)22-14/h8-10H,4-7H2,1-3H3,(H2,18,20,22)/p+1