N4-[2-(1,3-benzodioxol-5-yl)ethyl]-6-chloranyl-pyrimidine-2,4-diamine

Systemtic Name: N4-[2-(1,3-benzodioxol-5-yl)ethyl]-6-chloranyl-pyrimidine-2,4-diamine Openeye Name: N4-[2-(1,3-benzodioxol-5-yl)ethyl]-6-chloro-pyrimidine-2,4-diamine CAS Name: N4-[2-(1,3-benzodioxol-5-yl)ethyl]-6-chloropyrimidine-2,4-diamine IUPAC Name: 4-N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-chloropyrimidine-2,4-diamine Traditional Name: (2-amino-6-chloro-pyrimidin-4-yl)-homopiperonyl-amine Formula: C13H13ClN4O2 MolecularWeight: 292.72092

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC3=CC(=NC(=N3)N)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC3=CC(=NC(=N3)N)Cl

InChI

InChI=1S/C13H13ClN4O2/c14-11-6-12(18-13(15)17-11)16-4-3-8-1-2-9-10(5-8)20-7-19-9/h1-2,5-6H,3-4,7H2,(H3,15,16,17,18)