N6-(1,3-benzodioxol-5-yl)-N4-methyl-N4-(1-methylpiperidin-4-yl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(1,3-benzodioxol-5-yl)-N4-methyl-N4-(1-methylpiperidin-4-yl)pyrimidine-4,5,6-triamine Openeye Name: N6-(1,3-benzodioxol-5-yl)-N4-methyl-N4-(1-methyl-4-piperidyl)pyrimidine-4,5,6-triamine CAS Name: N6-(1,3-benzodioxol-5-yl)-N4-methyl-N4-(1-methyl-4-piperidinyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(1,3-benzodioxol-5-yl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(1,3-benzodioxol-5-ylamino)pyrimidin-4-yl]-methyl-(1-methyl-4-piperidyl)amine Formula: C18H24N6O2 MolecularWeight: 356.42216

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(C)C2=NC=NC(=C2N)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1CCC(CC1)N(C)C2=NC=NC(=C2N)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H24N6O2/c1-23-7-5-13(6-8-23)24(2)18-16(19)17(20-10-21-18)22-12-3-4-14-15(9-12)26-11-25-14/h3-4,9-10,13H,5-8,11,19H2,1-2H3,(H,20,21,22)