1-(propan-2-ylamino)-3-[4-(pyrazol-1-ylmethylsulfanyl)phenoxy]propan-2-ol

Systemtic Name: 1-(propan-2-ylamino)-3-[4-(pyrazol-1-ylmethylsulfanyl)phenoxy]propan-2-ol Openeye Name: 1-(isopropylamino)-3-[4-(pyrazol-1-ylmethylsulfanyl)phenoxy]propan-2-ol CAS Name: 1-(propan-2-ylamino)-3-[4-(1-pyrazolylmethylthio)phenoxy]-2-propanol IUPAC Name: 1-(propan-2-ylamino)-3-[4-(pyrazol-1-ylmethylsulfanyl)phenoxy]propan-2-ol Traditional Name: 1-(isopropylamino)-3-[4-(pyrazol-1-ylmethylthio)phenoxy]propan-2-ol Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=C(C=C1)SCN2C=CC=N2)O

Isomeric SMILES

CC(C)NCC(COC1=CC=C(C=C1)SCN2C=CC=N2)O

InChI

InChI=1S/C16H23N3O2S/c1-13(2)17-10-14(20)11-21-15-4-6-16(7-5-15)22-12-19-9-3-8-18-19/h3-9,13-14,17,20H,10-12H2,1-2H3