1-[2-(1-adamantyl)-2-(3-methylphenyl)sulfanyl-ethyl]imidazole

Systemtic Name: 1-[2-(1-adamantyl)-2-(3-methylphenyl)sulfanyl-ethyl]imidazole Openeye Name: 1-[2-(1-adamantyl)-2-(m-tolylsulfanyl)ethyl]imidazole CAS Name: 1-[2-(1-adamantyl)-2-[(3-methylphenyl)thio]ethyl]imidazole IUPAC Name: 1-[2-(1-adamantyl)-2-(3-methylphenyl)sulfanylethyl]imidazole Traditional Name: 1-[2-(1-adamantyl)-2-(m-tolylthio)ethyl]imidazole Formula: C22H28N2S MolecularWeight: 352.53612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SC(CN2C=CN=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC(=CC=C1)SC(CN2C=CN=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H28N2S/c1-16-3-2-4-20(7-16)25-21(14-24-6-5-23-15-24)22-11-17-8-18(12-22)10-19(9-17)13-22/h2-7,15,17-19,21H,8-14H2,1H3