6-cyclopropyl-2-piperazin-4-ium-1-yl-pyrimidine-4-carbonitrile

Systemtic Name: 6-cyclopropyl-2-piperazin-4-ium-1-yl-pyrimidine-4-carbonitrile Openeye Name: 6-cyclopropyl-2-piperazin-4-ium-1-yl-pyrimidine-4-carbonitrile CAS Name: 6-cyclopropyl-2-(1-piperazin-4-iumyl)-4-pyrimidinecarbonitrile IUPAC Name: 6-cyclopropyl-2-piperazin-4-ium-1-ylpyrimidine-4-carbonitrile Traditional Name: 6-cyclopropyl-2-piperazin-4-ium-1-yl-pyrimidine-4-carbonitrile Formula: C12H16N5+ MolecularWeight: 230.28894

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=NC(=C2)C#N)N3CC[NH2+]CC3

Isomeric SMILES

C1CC1C2=NC(=NC(=C2)C#N)N3CC[NH2+]CC3

InChI

InChI=1S/C12H15N5/c13-8-10-7-11(9-1-2-9)16-12(15-10)17-5-3-14-4-6-17/h7,9,14H,1-6H2/p+1