5-[(6-methyl-1,3-benzodioxol-5-yl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(6-methyl-1,3-benzodioxol-5-yl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(6-methyl-1,3-benzodioxol-5-yl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(6-methyl-1,3-benzodioxol-5-yl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(6-methyl-1,3-benzodioxol-5-yl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[(6-methyl-1,3-benzodioxol-5-yl)methyl]pyrimidin-4-yl]amine Formula: C13H14N4O2 MolecularWeight: 258.27586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1CC3=CN=C(N=C3N)N)OCO2

Isomeric SMILES

CC1=CC2=C(C=C1CC3=CN=C(N=C3N)N)OCO2

InChI

InChI=1S/C13H14N4O2/c1-7-2-10-11(19-6-18-10)4-8(7)3-9-5-16-13(15)17-12(9)14/h2,4-5H,3,6H2,1H3,(H4,14,15,16,17)