3-[2-[3-(tert-butylamino)-2-oxidanyl-propoxy]-5-(dimethylamino)phenyl]-1H-pyridazine-6-thione

Systemtic Name: 3-[2-[3-(tert-butylamino)-2-oxidanyl-propoxy]-5-(dimethylamino)phenyl]-1H-pyridazine-6-thione Openeye Name: 3-[2-[3-(tert-butylamino)-2-hydroxy-propoxy]-5-(dimethylamino)phenyl]-1H-pyridazine-6-thione CAS Name: 3-[2-[3-(tert-butylamino)-2-hydroxypropoxy]-5-(dimethylamino)phenyl]-1H-pyridazine-6-thione IUPAC Name: 3-[2-[3-(tert-butylamino)-2-hydroxypropoxy]-5-(dimethylamino)phenyl]-1H-pyridazine-6-thione Traditional Name: 3-[2-[3-(tert-butylamino)-2-hydroxy-propoxy]-5-(dimethylamino)phenyl]-1H-pyridazine-6-thione Formula: C19H28N4O2S MolecularWeight: 376.51622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=C(C=C(C=C1)N(C)C)C2=NNC(=S)C=C2)O

Isomeric SMILES

CC(C)(C)NCC(COC1=C(C=C(C=C1)N(C)C)C2=NNC(=S)C=C2)O

InChI

InChI=1S/C19H28N4O2S/c1-19(2,3)20-11-14(24)12-25-17-8-6-13(23(4)5)10-15(17)16-7-9-18(26)22-21-16/h6-10,14,20,24H,11-12H2,1-5H3,(H,22,26)