N6-(1,3-benzodioxol-5-yl)-N4-ethyl-N4-(3-methylphenyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(1,3-benzodioxol-5-yl)-N4-ethyl-N4-(3-methylphenyl)pyrimidine-4,5,6-triamine Openeye Name: N6-(1,3-benzodioxol-5-yl)-N4-ethyl-N4-(m-tolyl)pyrimidine-4,5,6-triamine CAS Name: N6-(1,3-benzodioxol-5-yl)-N4-ethyl-N4-(3-methylphenyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(1,3-benzodioxol-5-yl)-4-N-ethyl-4-N-(3-methylphenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(1,3-benzodioxol-5-ylamino)pyrimidin-4-yl]-ethyl-(m-tolyl)amine Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C2=NC=NC(=C2N)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C2=NC=NC(=C2N)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21N5O2/c1-3-25(15-6-4-5-13(2)9-15)20-18(21)19(22-11-23-20)24-14-7-8-16-17(10-14)27-12-26-16/h4-11H,3,12,21H2,1-2H3,(H,22,23,24)