5-(1-adamantylsulfanyl)-2-phenyl-pyridine

Systemtic Name: 5-(1-adamantylsulfanyl)-2-phenyl-pyridine Openeye Name: 5-(1-adamantylsulfanyl)-2-phenyl-pyridine CAS Name: 5-(1-adamantylthio)-2-phenylpyridine IUPAC Name: 5-(1-adamantylsulfanyl)-2-phenylpyridine Traditional Name: 5-(1-adamantylthio)-2-phenyl-pyridine Formula: C21H23NS MolecularWeight: 321.47902

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)SC4=CN=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)SC4=CN=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C21H23NS/c1-2-4-18(5-3-1)20-7-6-19(14-22-20)23-21-11-15-8-16(12-21)10-17(9-15)13-21/h1-7,14-17H,8-13H2