6-(2-thiophen-2-yl-4-bicyclo[2.2.2]octanyl)pyrimidine-2,4,5-triamine

Systemtic Name: 6-(2-thiophen-2-yl-4-bicyclo[2.2.2]octanyl)pyrimidine-2,4,5-triamine Openeye Name: 6-[2-(2-thienyl)-4-bicyclo[2.2.2]octanyl]pyrimidine-2,4,5-triamine CAS Name: 6-(2-thiophen-2-yl-4-bicyclo[2.2.2]octanyl)pyrimidine-2,4,5-triamine IUPAC Name: 6-(2-thiophen-2-yl-4-bicyclo[2.2.2]octanyl)pyrimidine-2,4,5-triamine Traditional Name: [2,4-diamino-6-[2-(2-thienyl)-4-bicyclo[2.2.2]octanyl]pyrimidin-5-yl]amine Formula: C16H21N5S MolecularWeight: 315.43644

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1C(C2)C3=CC=CS3)C4=C(C(=NC(=N4)N)N)N

Isomeric SMILES

C1CC2(CCC1C(C2)C3=CC=CS3)C4=C(C(=NC(=N4)N)N)N

InChI

InChI=1S/C16H21N5S/c17-12-13(20-15(19)21-14(12)18)16-5-3-9(4-6-16)10(8-16)11-2-1-7-22-11/h1-2,7,9-10H,3-6,8,17H2,(H4,18,19,20,21)