2-(1-adamantyl)-N-[(5-iodanyl-6-methyl-pyridin-2-yl)carbamothioyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[(5-iodanyl-6-methyl-pyridin-2-yl)carbamothioyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[(5-iodo-6-methyl-2-pyridyl)carbamothioyl]acetamide CAS Name: 2-(1-adamantyl)-N-[[(5-iodo-6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[(5-iodo-6-methylpyridin-2-yl)carbamothioyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[(5-iodo-6-methyl-2-pyridyl)thiocarbamoyl]acetamide Formula: C19H24IN3OS MolecularWeight: 469.38283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)NC(=S)NC(=O)CC23CC4CC(C2)CC(C4)C3)I

Isomeric SMILES

CC1=C(C=CC(=N1)NC(=S)NC(=O)CC23CC4CC(C2)CC(C4)C3)I

InChI

InChI=1S/C19H24IN3OS/c1-11-15(20)2-3-16(21-11)22-18(25)23-17(24)10-19-7-12-4-13(8-19)6-14(5-12)9-19/h2-3,12-14H,4-10H2,1H3,(H2,21,22,23,24,25)