2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(1-cyanocyclopentyl)ethanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(1-cyanocyclopentyl)ethanamide Openeye Name: N-(1-cyanocyclopentyl)-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(1-cyanocyclopentyl)-2-[(4,6-diamino-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(1-cyanocyclopentyl)-2-(4,6-diaminopyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(1-cyanocyclopentyl)-2-[(4,6-diaminopyrimidin-2-yl)thio]acetamide Formula: C12H16N6OS MolecularWeight: 292.36004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)CSC2=NC(=CC(=N2)N)N

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)CSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C12H16N6OS/c13-7-12(3-1-2-4-12)18-10(19)6-20-11-16-8(14)5-9(15)17-11/h5H,1-4,6H2,(H,18,19)(H4,14,15,16,17)