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

Systemtic Name: N6-(1,3-benzodioxol-5-ylmethyl)-N4-(4,5-dimethyl-1,3-thiazol-2-yl)pyrimidine-4,5,6-triamine Openeye Name: N6-(1,3-benzodioxol-5-ylmethyl)-N4-(4,5-dimethylthiazol-2-yl)pyrimidine-4,5,6-triamine CAS Name: N6-(1,3-benzodioxol-5-ylmethyl)-N4-(4,5-dimethyl-2-thiazolyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(1,3-benzodioxol-5-ylmethyl)-4-N-(4,5-dimethyl-1,3-thiazol-2-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-[(4,5-dimethylthiazol-2-yl)amino]pyrimidin-4-yl]-piperonyl-amine Formula: C17H18N6O2S MolecularWeight: 370.42882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC2=C(C(=NC=N2)NCC3=CC4=C(C=C3)OCO4)N)C

Isomeric SMILES

CC1=C(SC(=N1)NC2=C(C(=NC=N2)NCC3=CC4=C(C=C3)OCO4)N)C

InChI

InChI=1S/C17H18N6O2S/c1-9-10(2)26-17(22-9)23-16-14(18)15(20-7-21-16)19-6-11-3-4-12-13(5-11)25-8-24-12/h3-5,7H,6,8,18H2,1-2H3,(H2,19,20,21,22,23)