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

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(1-isobutylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[(1-isobutylbenzimidazol-2-yl)thio]acetamide Formula: C25H35N3OS MolecularWeight: 425.6299

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2N=C1SCC(=O)NC(C)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)CSC4=NC5=CC=CC=C5N4CC(C)C

InChI

InChI=1S/C25H35N3OS/c1-16(2)14-28-22-7-5-4-6-21(22)27-24(28)30-15-23(29)26-17(3)25-11-18-8-19(12-25)10-20(9-18)13-25/h4-7,16-20H,8-15H2,1-3H3,(H,26,29)/t17-,18?,19?,20?,25?/m1/s1