N-(1-adamantylmethyl)-2-[(1R)-1-(1H-benzimidazol-2-yl)ethyl]sulfanyl-ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[(1R)-1-(1H-benzimidazol-2-yl)ethyl]sulfanyl-ethanamide Openeye Name: N-(1-adamantylmethyl)-2-[(1R)-1-(1H-benzimidazol-2-yl)ethyl]sulfanyl-acetamide CAS Name: N-(1-adamantylmethyl)-2-[[(1R)-1-(1H-benzimidazol-2-yl)ethyl]thio]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-[(1R)-1-(1H-benzimidazol-2-yl)ethyl]sulfanylacetamide Traditional Name: N-(1-adamantylmethyl)-2-[[(1R)-1-(1H-benzimidazol-2-yl)ethyl]thio]acetamide Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1)SCC(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2N1)SCC(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H29N3OS/c1-14(21-24-18-4-2-3-5-19(18)25-21)27-12-20(26)23-13-22-9-15-6-16(10-22)8-17(7-15)11-22/h2-5,14-17H,6-13H2,1H3,(H,23,26)(H,24,25)/t14-,15?,16?,17?,22?/m1/s1