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

Systemtic Name: N-(1-adamantylcarbamoyl)-2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[(4,6-diamino-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-(4,6-diaminopyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[(4,6-diaminopyrimidin-2-yl)thio]acetamide Formula: C17H24N6O2S MolecularWeight: 376.47646

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CSC4=NC(=CC(=N4)N)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CSC4=NC(=CC(=N4)N)N

InChI

InChI=1S/C17H24N6O2S/c18-12-4-13(19)21-16(20-12)26-8-14(24)22-15(25)23-17-5-9-1-10(6-17)3-11(2-9)7-17/h4,9-11H,1-3,5-8H2,(H4,18,19,20,21)(H2,22,23,24,25)