1-(2-methyloctylamino)-3-(4-propan-2-ylsulfanylphenoxy)propan-2-ol

Systemtic Name: 1-(2-methyloctylamino)-3-(4-propan-2-ylsulfanylphenoxy)propan-2-ol Openeye Name: 1-(4-isopropylsulfanylphenoxy)-3-(2-methyloctylamino)propan-2-ol CAS Name: 1-(2-methyloctylamino)-3-[4-(propan-2-ylthio)phenoxy]-2-propanol IUPAC Name: 1-(2-methyloctylamino)-3-(4-propan-2-ylsulfanylphenoxy)propan-2-ol Traditional Name: 1-[4-(isopropylthio)phenoxy]-3-(2-methyloctylamino)propan-2-ol Formula: C21H37NO2S MolecularWeight: 367.58898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)CNCC(COC1=CC=C(C=C1)SC(C)C)O

Isomeric SMILES

CCCCCCC(C)CNCC(COC1=CC=C(C=C1)SC(C)C)O

InChI

InChI=1S/C21H37NO2S/c1-5-6-7-8-9-18(4)14-22-15-19(23)16-24-20-10-12-21(13-11-20)25-17(2)3/h10-13,17-19,22-23H,5-9,14-16H2,1-4H3