3-[2-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-1H-pyridazine-6-thione

Systemtic Name: 3-[2-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-1H-pyridazine-6-thione Openeye Name: 3-[2-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-1H-pyridazine-6-thione CAS Name: 3-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1H-pyridazine-6-thione IUPAC Name: 3-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1H-pyridazine-6-thione Traditional Name: 3-[2-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-1H-pyridazine-6-thione Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC=CC=C1C2=NNC(=S)C=C2)O

Isomeric SMILES

CC(C)(C)NCC(COC1=CC=CC=C1C2=NNC(=S)C=C2)O

InChI

InChI=1S/C17H23N3O2S/c1-17(2,3)18-10-12(21)11-22-15-7-5-4-6-13(15)14-8-9-16(23)20-19-14/h4-9,12,18,21H,10-11H2,1-3H3,(H,20,23)