1-(tert-butylamino)-3-[2-(2-pyrazin-2-ylethynyl)phenoxy]propan-2-ol hydrochloride

Systemtic Name: 1-(tert-butylamino)-3-[2-(2-pyrazin-2-ylethynyl)phenoxy]propan-2-ol hydrochloride Openeye Name: 1-(tert-butylamino)-3-[2-(2-pyrazin-2-ylethynyl)phenoxy]propan-2-ol hydrochloride CAS Name: 1-(tert-butylamino)-3-[2-[2-(2-pyrazinyl)ethynyl]phenoxy]-2-propanol hydrochloride IUPAC Name: 1-(tert-butylamino)-3-[2-(2-pyrazin-2-ylethynyl)phenoxy]propan-2-ol hydrochloride Traditional Name: 1-(tert-butylamino)-3-[2-(2-pyrazin-2-ylethynyl)phenoxy]propan-2-ol hydrochloride Formula: C19H24ClN3O2 MolecularWeight: 361.86576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC=CC=C1C#CC2=NC=CN=C2)O.Cl

Isomeric SMILES

CC(C)(C)NCC(COC1=CC=CC=C1C#CC2=NC=CN=C2)O.Cl

InChI

InChI=1S/C19H23N3O2.ClH/c1-19(2,3)22-13-17(23)14-24-18-7-5-4-6-15(18)8-9-16-12-20-10-11-21-16;/h4-7,10-12,17,22-23H,13-14H2,1-3H3;1H