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

Systemtic Name: 4-chloranyl-6-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]pyrimidin-2-amine Openeye Name: 4-chloro-6-[4-(3-pyridylmethyl)piperazin-4-ium-1-yl]pyrimidin-2-amine CAS Name: 4-chloro-6-[4-(3-pyridinylmethyl)-1-piperazin-4-iumyl]-2-pyrimidinamine IUPAC Name: 4-chloro-6-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]pyrimidin-2-amine Traditional Name: [4-chloro-6-[4-(3-pyridylmethyl)piperazin-4-ium-1-yl]pyrimidin-2-yl]amine Formula: C14H18ClN6+ MolecularWeight: 305.78592

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CN=CC=C2)C3=CC(=NC(=N3)N)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CN=CC=C2)C3=CC(=NC(=N3)N)Cl

InChI

InChI=1S/C14H17ClN6/c15-12-8-13(19-14(16)18-12)21-6-4-20(5-7-21)10-11-2-1-3-17-9-11/h1-3,8-9H,4-7,10H2,(H2,16,18,19)/p+1