N4-(1,3-benzodioxol-5-yl)-N6-(2-methoxyethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-(1,3-benzodioxol-5-yl)-N6-(2-methoxyethyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(1,3-benzodioxol-5-yl)-N6-(2-methoxyethyl)pyrimidine-4,5,6-triamine CAS Name: N4-(1,3-benzodioxol-5-yl)-N6-(2-methoxyethyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(1,3-benzodioxol-5-yl)-6-N-(2-methoxyethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(1,3-benzodioxol-5-ylamino)pyrimidin-4-yl]-(2-methoxyethyl)amine Formula: C14H17N5O3 MolecularWeight: 303.31648

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NC=NC(=C1N)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COCCNC1=NC=NC(=C1N)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H17N5O3/c1-20-5-4-16-13-12(15)14(18-7-17-13)19-9-2-3-10-11(6-9)22-8-21-10/h2-3,6-7H,4-5,8,15H2,1H3,(H2,16,17,18,19)