N-[4-(1-adamantyl)phenyl]-2-(1,3-benzoxazol-2-ylsulfanyl)ethanamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-2-(1,3-benzoxazol-2-ylsulfanyl)ethanamide Openeye Name: N-[4-(1-adamantyl)phenyl]-2-(1,3-benzoxazol-2-ylsulfanyl)acetamide CAS Name: N-[4-(1-adamantyl)phenyl]-2-(1,3-benzoxazol-2-ylthio)acetamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-2-(1,3-benzoxazol-2-ylsulfanyl)acetamide Traditional Name: N-[4-(1-adamantyl)phenyl]-2-(1,3-benzoxazol-2-ylthio)acetamide Formula: C25H26N2O2S MolecularWeight: 418.55114

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)CSC5=NC6=CC=CC=C6O5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)CSC5=NC6=CC=CC=C6O5

InChI

InChI=1S/C25H26N2O2S/c28-23(15-30-24-27-21-3-1-2-4-22(21)29-24)26-20-7-5-19(6-8-20)25-12-16-9-17(13-25)11-18(10-16)14-25/h1-8,16-18H,9-15H2,(H,26,28)