N-(1-adamantylcarbamoyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[(1-methyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-(1-methylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[(1-methylbenzimidazol-2-yl)thio]acetamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SCC(=O)NC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SCC(=O)NC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H26N4O2S/c1-25-17-5-3-2-4-16(17)22-20(25)28-12-18(26)23-19(27)24-21-9-13-6-14(10-21)8-15(7-13)11-21/h2-5,13-15H,6-12H2,1H3,(H2,23,24,26,27)