6-(furan-2-yl)-2-piperazin-4-ium-1-yl-pyrimidine-4-carbonitrile

Systemtic Name: 6-(furan-2-yl)-2-piperazin-4-ium-1-yl-pyrimidine-4-carbonitrile Openeye Name: 6-(2-furyl)-2-piperazin-4-ium-1-yl-pyrimidine-4-carbonitrile CAS Name: 6-(2-furanyl)-2-(1-piperazin-4-iumyl)-4-pyrimidinecarbonitrile IUPAC Name: 6-(furan-2-yl)-2-piperazin-4-ium-1-ylpyrimidine-4-carbonitrile Traditional Name: 6-(2-furyl)-2-piperazin-4-ium-1-yl-pyrimidine-4-carbonitrile Formula: C13H14N5O+ MolecularWeight: 256.28316

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC(=CC(=N2)C3=CC=CO3)C#N

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC(=CC(=N2)C3=CC=CO3)C#N

InChI

InChI=1S/C13H13N5O/c14-9-10-8-11(12-2-1-7-19-12)17-13(16-10)18-5-3-15-4-6-18/h1-2,7-8,15H,3-6H2/p+1