5-(1,3-benzodioxol-5-ylmethyl)pyrimidine-2,4-diamine

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethyl)pyrimidine-2,4-diamine Openeye Name: 5-(1,3-benzodioxol-5-ylmethyl)pyrimidine-2,4-diamine CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)pyrimidine-2,4-diamine IUPAC Name: 5-(1,3-benzodioxol-5-ylmethyl)pyrimidine-2,4-diamine Traditional Name: (2-amino-5-piperonyl-pyrimidin-4-yl)amine Formula: C12H12N4O2 MolecularWeight: 244.24928

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC3=CN=C(N=C3N)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CC3=CN=C(N=C3N)N

InChI

InChI=1S/C12H12N4O2/c13-11-8(5-15-12(14)16-11)3-7-1-2-9-10(4-7)18-6-17-9/h1-2,4-5H,3,6H2,(H4,13,14,15,16)