1-(1-adamantylamino)-3-(3,4-dihydro-2H-thiochromen-8-yloxy)propan-2-ol

Systemtic Name: 1-(1-adamantylamino)-3-(3,4-dihydro-2H-thiochromen-8-yloxy)propan-2-ol Openeye Name: 1-(1-adamantylamino)-3-thiochroman-8-yloxy-propan-2-ol CAS Name: 1-(1-adamantylamino)-3-(3,4-dihydro-2H-1-benzothiopyran-8-yloxy)-2-propanol IUPAC Name: 1-(1-adamantylamino)-3-(3,4-dihydro-2H-thiochromen-8-yloxy)propan-2-ol Traditional Name: 1-(1-adamantylamino)-3-thiochroman-8-yloxy-propan-2-ol Formula: C22H31NO2S MolecularWeight: 373.55204

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=CC=C2)OCC(CNC34CC5CC(C3)CC(C5)C4)O)SC1

Isomeric SMILES

C1CC2=C(C(=CC=C2)OCC(CNC34CC5CC(C3)CC(C5)C4)O)SC1

InChI

InChI=1S/C22H31NO2S/c24-19(14-25-20-5-1-3-18-4-2-6-26-21(18)20)13-23-22-10-15-7-16(11-22)9-17(8-15)12-22/h1,3,5,15-17,19,23-24H,2,4,6-14H2