N-(1-adamantyl)-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1-adamantyl)-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1-adamantyl)-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(1-adamantyl)-2-[[1-(4-methoxyphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(1-adamantyl)-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(1-adamantyl)-2-[[1-(4-methoxyphenyl)imidazol-2-yl]thio]acetamide Formula: C22H27N3O2S MolecularWeight: 397.53368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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