5-methyl-N2-[(3-propyl-1,2-oxazol-5-yl)methyl]pyrimidin-1-ium-2,4-diamine

Systemtic Name: 5-methyl-N2-[(3-propyl-1,2-oxazol-5-yl)methyl]pyrimidin-1-ium-2,4-diamine Openeye Name: 5-methyl-N2-[(3-propylisoxazol-5-yl)methyl]pyrimidin-1-ium-2,4-diamine CAS Name: 5-methyl-N2-[(3-propyl-5-isoxazolyl)methyl]pyrimidin-1-ium-2,4-diamine IUPAC Name: 5-methyl-2-N-[(3-propyl-1,2-oxazol-5-yl)methyl]pyrimidin-1-ium-2,4-diamine Traditional Name: (4-amino-5-methyl-pyrimidin-1-ium-2-yl)-[(3-propylisoxazol-5-yl)methyl]amine Formula: C12H18N5O+ MolecularWeight: 248.30422

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NOC(=C1)CNC2=[NH+]C=C(C(=N2)N)C

Isomeric SMILES

CCCC1=NOC(=C1)CNC2=[NH+]C=C(C(=N2)N)C

InChI

InChI=1S/C12H17N5O/c1-3-4-9-5-10(18-17-9)7-15-12-14-6-8(2)11(13)16-12/h5-6H,3-4,7H2,1-2H3,(H3,13,14,15,16)/p+1