N-(1-adamantyl)-2-[[5,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[[5,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: N-(1-adamantyl)-2-[(5,6-diamino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(1-adamantyl)-2-[(5,6-diamino-4-oxo-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(1-adamantyl)-2-[(5,6-diamino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-(1-adamantyl)-2-[(5,6-diamino-4-keto-1H-pyrimidin-2-yl)thio]acetamide Formula: C16H23N5O2S MolecularWeight: 349.45112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N5O2S/c17-12-13(18)19-15(20-14(12)23)24-7-11(22)21-16-4-8-1-9(5-16)3-10(2-8)6-16/h8-10H,1-7,17H2,(H,21,22)(H3,18,19,20,23)