N-[(1R)-1-(1-adamantyl)ethyl]-2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[2-[(methylthio)methyl]-1-benzimidazolyl]acetamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[2-[(methylthio)methyl]benzimidazol-1-yl]acetamide Formula: C23H31N3OS MolecularWeight: 397.57674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CN4C5=CC=CC=C5N=C4CSC

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)CN4C5=CC=CC=C5N=C4CSC

InChI

InChI=1S/C23H31N3OS/c1-15(23-10-16-7-17(11-23)9-18(8-16)12-23)24-22(27)13-26-20-6-4-3-5-19(20)25-21(26)14-28-2/h3-6,15-18H,7-14H2,1-2H3,(H,24,27)/t15-,16?,17?,18?,23?/m1/s1