3-[5-[2-(1-adamantyl)ethylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 3-[5-[2-(1-adamantyl)ethylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[5-[2-(1-adamantyl)ethylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[5-[2-(1-adamantyl)ethylthio]-4-methyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[5-[2-(1-adamantyl)ethylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[5-[2-(1-adamantyl)ethylthio]-4-methyl-1,2,4-triazol-3-yl]pyridine Formula: C20H26N4S MolecularWeight: 354.51224

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCC23CC4CC(C2)CC(C4)C3)C5=CN=CC=C5

Isomeric SMILES

CN1C(=NN=C1SCCC23CC4CC(C2)CC(C4)C3)C5=CN=CC=C5

InChI

InChI=1S/C20H26N4S/c1-24-18(17-3-2-5-21-13-17)22-23-19(24)25-6-4-20-10-14-7-15(11-20)9-16(8-14)12-20/h2-3,5,13-16H,4,6-12H2,1H3