N4-(1,3-benzodioxol-5-ylmethyl)-6-chloranyl-pyrimidine-2,4-diamine

Systemtic Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-chloranyl-pyrimidine-2,4-diamine Openeye Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-chloro-pyrimidine-2,4-diamine CAS Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-chloropyrimidine-2,4-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-ylmethyl)-6-chloropyrimidine-2,4-diamine Traditional Name: (2-amino-6-chloro-pyrimidin-4-yl)-piperonyl-amine Formula: C12H11ClN4O2 MolecularWeight: 278.69434

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=CC(=NC(=N3)N)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=CC(=NC(=N3)N)Cl

InChI

InChI=1S/C12H11ClN4O2/c13-10-4-11(17-12(14)16-10)15-5-7-1-2-8-9(3-7)19-6-18-8/h1-4H,5-6H2,(H3,14,15,16,17)