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

Systemtic Name: N-(1-adamantyl)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: N-(1-adamantyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: N-(1-adamantyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: N-(1-adamantyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: N-(1-adamantyl)-2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]propionamide Formula: C20H29N3O2S MolecularWeight: 375.52816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC(C)C(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SC(C)C(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H29N3O2S/c1-3-4-16-8-17(24)22-19(21-16)26-12(2)18(25)23-20-9-13-5-14(10-20)7-15(6-13)11-20/h8,12-15H,3-7,9-11H2,1-2H3,(H,23,25)(H,21,22,24)