N4-tert-butyl-N6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-tert-butyl-N6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-4,5,6-triamine Openeye Name: N4-tert-butyl-N6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-4,5,6-triamine CAS Name: N4-tert-butyl-N6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-tert-butyl-6-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(tert-butylamino)pyrimidin-4-yl]-(2,3-dihydro-1,4-benzodioxin-6-yl)amine Formula: C16H21N5O2 MolecularWeight: 315.37024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC=NC(=C1N)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)(C)NC1=NC=NC(=C1N)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H21N5O2/c1-16(2,3)21-15-13(17)14(18-9-19-15)20-10-4-5-11-12(8-10)23-7-6-22-11/h4-5,8-9H,6-7,17H2,1-3H3,(H2,18,19,20,21)