5-[(7-ethoxy-1,3-benzodioxol-5-yl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(7-ethoxy-1,3-benzodioxol-5-yl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(7-ethoxy-1,3-benzodioxol-5-yl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(7-ethoxy-1,3-benzodioxol-5-yl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(7-ethoxy-1,3-benzodioxol-5-yl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[(7-ethoxy-1,3-benzodioxol-5-yl)methyl]pyrimidin-4-yl]amine Formula: C14H16N4O3 MolecularWeight: 288.30184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC2=C1OCO2)CC3=CN=C(N=C3N)N

Isomeric SMILES

CCOC1=CC(=CC2=C1OCO2)CC3=CN=C(N=C3N)N

InChI

InChI=1S/C14H16N4O3/c1-2-19-10-4-8(5-11-12(10)21-7-20-11)3-9-6-17-14(16)18-13(9)15/h4-6H,2-3,7H2,1H3,(H4,15,16,17,18)