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

Systemtic Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-(4-ethylpiperazin-1-yl)pyrimidine-4,5-diamine Openeye Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-(4-ethylpiperazin-1-yl)pyrimidine-4,5-diamine CAS Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-(4-ethyl-1-piperazinyl)pyrimidine-4,5-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-ylmethyl)-6-(4-ethylpiperazin-1-yl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(4-ethylpiperazino)pyrimidin-4-yl]-piperonyl-amine Formula: C18H24N6O2 MolecularWeight: 356.42216

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C(=NC=N2)NCC3=CC4=C(C=C3)OCO4)N

Isomeric SMILES

CCN1CCN(CC1)C2=C(C(=NC=N2)NCC3=CC4=C(C=C3)OCO4)N

InChI

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