N-[3-(3-thieno[2,3-d][1,2]oxazol-3-ylphenoxy)propyl]adamantan-1-amine

Systemtic Name: N-[3-(3-thieno[2,3-d][1,2]oxazol-3-ylphenoxy)propyl]adamantan-1-amine Openeye Name: N-[3-(3-thieno[2,3-d]isoxazol-3-ylphenoxy)propyl]adamantan-1-amine CAS Name: N-[3-[3-(3-thieno[2,3-d]isoxazolyl)phenoxy]propyl]-1-adamantanamine IUPAC Name: N-[3-(3-thieno[2,3-d][1,2]oxazol-3-ylphenoxy)propyl]adamantan-1-amine Traditional Name: 1-adamantyl-[3-(3-thien[2,3-d]isoxazol-3-ylphenoxy)propyl]amine Formula: C24H28N2O2S MolecularWeight: 408.55632

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NCCCOC4=CC=CC(=C4)C5=NOC6=C5SC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NCCCOC4=CC=CC(=C4)C5=NOC6=C5SC=C6

InChI

InChI=1S/C24H28N2O2S/c1-3-19(22-23-21(28-26-22)5-8-29-23)12-20(4-1)27-7-2-6-25-24-13-16-9-17(14-24)11-18(10-16)15-24/h1,3-5,8,12,16-18,25H,2,6-7,9-11,13-15H2