N4-(1,3-benzodioxol-5-yl)-6-(3,4-dimethylphenoxy)pyrimidine-4,5-diamine

Systemtic Name: N4-(1,3-benzodioxol-5-yl)-6-(3,4-dimethylphenoxy)pyrimidine-4,5-diamine Openeye Name: N4-(1,3-benzodioxol-5-yl)-6-(3,4-dimethylphenoxy)pyrimidine-4,5-diamine CAS Name: N4-(1,3-benzodioxol-5-yl)-6-(3,4-dimethylphenoxy)pyrimidine-4,5-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-yl)-6-(3,4-dimethylphenoxy)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(3,4-dimethylphenoxy)pyrimidin-4-yl]-(1,3-benzodioxol-5-yl)amine Formula: C19H18N4O3 MolecularWeight: 350.37122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2=NC=NC(=C2N)NC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC2=NC=NC(=C2N)NC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C19H18N4O3/c1-11-3-5-14(7-12(11)2)26-19-17(20)18(21-9-22-19)23-13-4-6-15-16(8-13)25-10-24-15/h3-9H,10,20H2,1-2H3,(H,21,22,23)