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

Systemtic Name: 2-[2-(1-adamantyl)ethylsulfanyl]pyrimidine Openeye Name: 2-[2-(1-adamantyl)ethylsulfanyl]pyrimidine CAS Name: 2-[2-(1-adamantyl)ethylthio]pyrimidine IUPAC Name: 2-[2-(1-adamantyl)ethylsulfanyl]pyrimidine Traditional Name: 2-[2-(1-adamantyl)ethylthio]pyrimidine Formula: C16H22N2S MolecularWeight: 274.42428

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CCSC4=NC=CC=N4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CCSC4=NC=CC=N4

InChI

InChI=1S/C16H22N2S/c1-3-17-15(18-4-1)19-5-2-16-9-12-6-13(10-16)8-14(7-12)11-16/h1,3-4,12-14H,2,5-11H2