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

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(1-cyanocyclohexyl)-N-methyl-ethanamide Openeye Name: N-(1-cyanocyclohexyl)-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-methyl-acetamide CAS Name: N-(1-cyanocyclohexyl)-2-[(4,6-diamino-2-pyrimidinyl)thio]-N-methylacetamide IUPAC Name: N-(1-cyanocyclohexyl)-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-methylacetamide Traditional Name: N-(1-cyanocyclohexyl)-2-[(4,6-diaminopyrimidin-2-yl)thio]-N-methyl-acetamide Formula: C14H20N6OS MolecularWeight: 320.4132

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CSC1=NC(=CC(=N1)N)N)C2(CCCCC2)C#N

Isomeric SMILES

CN(C(=O)CSC1=NC(=CC(=N1)N)N)C2(CCCCC2)C#N

InChI

InChI=1S/C14H20N6OS/c1-20(14(9-15)5-3-2-4-6-14)12(21)8-22-13-18-10(16)7-11(17)19-13/h7H,2-6,8H2,1H3,(H4,16,17,18,19)