N-(1-adamantyl)-2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(1-adamantyl)-2-[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(1-adamantyl)-2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(1-adamantyl)-2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(1-adamantyl)-2-[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C24H32N4OS MolecularWeight: 424.60208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)NC23CC4CC(C2)CC(C4)C3)C5=CC(=CC=C5)C

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)NC23CC4CC(C2)CC(C4)C3)C5=CC(=CC=C5)C

InChI

InChI=1S/C24H32N4OS/c1-3-7-28-22(20-6-4-5-16(2)8-20)26-27-23(28)30-15-21(29)25-24-12-17-9-18(13-24)11-19(10-17)14-24/h4-6,8,17-19H,3,7,9-15H2,1-2H3,(H,25,29)