2-[[azanyl-(4-methylpiperazine-1,4-diium-1-ylidene)methyl]amino]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[[azanyl-(4-methylpiperazine-1,4-diium-1-ylidene)methyl]amino]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[[amino-(4-methylpiperazine-1,4-diium-1-ylidene)methyl]amino]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[[amino-(4-methyl-1-piperazine-1,4-diiumylidene)methyl]amino]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[[amino-(4-methylpiperazine-1,4-diium-1-ylidene)methyl]amino]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[[amino-(4-methylpiperazine-1,4-diium-1-ylidene)methyl]amino]-6-methyl-1H-pyrimidin-4-one Formula: C11H20N6O+2 MolecularWeight: 252.3161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)NC(=[N+]2CC[NH+](CC2)C)N

Isomeric SMILES

CC1=CC(=O)N=C(N1)NC(=[N+]2CC[NH+](CC2)C)N

InChI

InChI=1S/C11H18N6O/c1-8-7-9(18)14-11(13-8)15-10(12)17-5-3-16(2)4-6-17/h7H,3-6H2,1-2H3,(H3,12,13,14,15,18)/p+2