2-[2-(1-adamantyl)ethylsulfanyl]-4-methyl-pyrimidine

Systemtic Name: 2-[2-(1-adamantyl)ethylsulfanyl]-4-methyl-pyrimidine Openeye Name: 2-[2-(1-adamantyl)ethylsulfanyl]-4-methyl-pyrimidine CAS Name: 2-[2-(1-adamantyl)ethylthio]-4-methylpyrimidine IUPAC Name: 2-[2-(1-adamantyl)ethylsulfanyl]-4-methylpyrimidine Traditional Name: 2-[2-(1-adamantyl)ethylthio]-4-methyl-pyrimidine Formula: C17H24N2S MolecularWeight: 288.45086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=NC(=NC=C1)SCCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C17H24N2S/c1-12-2-4-18-16(19-12)20-5-3-17-9-13-6-14(10-17)8-15(7-13)11-17/h2,4,13-15H,3,5-11H2,1H3