N-(1-adamantylcarbamoyl)-3-(1,3-benzoxazol-2-ylsulfanyl)propanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-3-(1,3-benzoxazol-2-ylsulfanyl)propanamide Openeye Name: N-(1-adamantylcarbamoyl)-3-(1,3-benzoxazol-2-ylsulfanyl)propanamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-3-(1,3-benzoxazol-2-ylthio)propanamide IUPAC Name: N-(1-adamantylcarbamoyl)-3-(1,3-benzoxazol-2-ylsulfanyl)propanamide Traditional Name: N-(1-adamantylcarbamoyl)-3-(1,3-benzoxazol-2-ylthio)propionamide Formula: C21H25N3O3S MolecularWeight: 399.5065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CCSC4=NC5=CC=CC=C5O4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CCSC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C21H25N3O3S/c25-18(5-6-28-20-22-16-3-1-2-4-17(16)27-20)23-19(26)24-21-10-13-7-14(11-21)9-15(8-13)12-21/h1-4,13-15H,5-12H2,(H2,23,24,25,26)