N4-(5-methyl-1,2-oxazol-3-yl)-N6-(2-thiophen-2-ylethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-(5-methyl-1,2-oxazol-3-yl)-N6-(2-thiophen-2-ylethyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(5-methylisoxazol-3-yl)-N6-[2-(2-thienyl)ethyl]pyrimidine-4,5,6-triamine CAS Name: N4-(5-methyl-3-isoxazolyl)-N6-(2-thiophen-2-ylethyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(5-methyl-1,2-oxazol-3-yl)-6-N-(2-thiophen-2-ylethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-[(5-methylisoxazol-3-yl)amino]pyrimidin-4-yl]-[2-(2-thienyl)ethyl]amine Formula: C14H16N6OS MolecularWeight: 316.38144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC2=C(C(=NC=N2)NCCC3=CC=CS3)N

Isomeric SMILES

CC1=CC(=NO1)NC2=C(C(=NC=N2)NCCC3=CC=CS3)N

InChI

InChI=1S/C14H16N6OS/c1-9-7-11(20-21-9)19-14-12(15)13(17-8-18-14)16-5-4-10-3-2-6-22-10/h2-3,6-8H,4-5,15H2,1H3,(H2,16,17,18,19,20)