N-(1-adamantyl)-2-[[4-(2-methylpropoxy)-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[[4-(2-methylpropoxy)-6-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: N-(1-adamantyl)-2-[(4-isobutoxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(1-adamantyl)-2-[[4-(2-methylpropoxy)-6-oxo-1H-pyrimidin-2-yl]thio]acetamide IUPAC Name: N-(1-adamantyl)-2-[[4-(2-methylpropoxy)-6-oxo-1H-pyrimidin-2-yl]sulfanyl]acetamide Traditional Name: N-(1-adamantyl)-2-[(4-isobutoxy-6-keto-1H-pyrimidin-2-yl)thio]acetamide Formula: C20H29N3O3S MolecularWeight: 391.52756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC(=O)NC(=N1)SCC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)COC1=CC(=O)NC(=N1)SCC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H29N3O3S/c1-12(2)10-26-18-6-16(24)21-19(22-18)27-11-17(25)23-20-7-13-3-14(8-20)5-15(4-13)9-20/h6,12-15H,3-5,7-11H2,1-2H3,(H,23,25)(H,21,22,24)