N-(1-adamantyl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1-adamantyl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1-adamantyl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(1-adamantyl)-2-[[1-(3-methoxyphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(1-adamantyl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(1-adamantyl)-2-[[1-(3-methoxyphenyl)imidazol-2-yl]thio]acetamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=CN=C2SCC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=CC(=C1)N2C=CN=C2SCC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27N3O2S/c1-27-19-4-2-3-18(10-19)25-6-5-23-21(25)28-14-20(26)24-22-11-15-7-16(12-22)9-17(8-15)13-22/h2-6,10,15-17H,7-9,11-14H2,1H3,(H,24,26)