3-[2-(1-adamantyl)ethylsulfanyl]-5-propan-2-yl-1H-1,2,4-triazole

Systemtic Name: 3-[2-(1-adamantyl)ethylsulfanyl]-5-propan-2-yl-1H-1,2,4-triazole Openeye Name: 3-[2-(1-adamantyl)ethylsulfanyl]-5-isopropyl-1H-1,2,4-triazole CAS Name: 3-[2-(1-adamantyl)ethylthio]-5-propan-2-yl-1H-1,2,4-triazole IUPAC Name: 3-[2-(1-adamantyl)ethylsulfanyl]-5-propan-2-yl-1H-1,2,4-triazole Traditional Name: 3-[2-(1-adamantyl)ethylthio]-5-isopropyl-1H-1,2,4-triazole Formula: C17H27N3S MolecularWeight: 305.48138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NN1)SCCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)C1=NC(=NN1)SCCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C17H27N3S/c1-11(2)15-18-16(20-19-15)21-4-3-17-8-12-5-13(9-17)7-14(6-12)10-17/h11-14H,3-10H2,1-2H3,(H,18,19,20)