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

Systemtic Name: 3-[2-[2-oxidanyl-3-(phenethylamino)propoxy]phenyl]-1H-pyridazine-6-thione Openeye Name: 3-[2-[2-hydroxy-3-(phenethylamino)propoxy]phenyl]-1H-pyridazine-6-thione CAS Name: 3-[2-[2-hydroxy-3-(phenethylamino)propoxy]phenyl]-1H-pyridazine-6-thione IUPAC Name: 3-[2-[2-hydroxy-3-(phenethylamino)propoxy]phenyl]-1H-pyridazine-6-thione Traditional Name: 3-[2-[2-hydroxy-3-(phenethylamino)propoxy]phenyl]-1H-pyridazine-6-thione Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNCC(COC2=CC=CC=C2C3=NNC(=S)C=C3)O

Isomeric SMILES

C1=CC=C(C=C1)CCNCC(COC2=CC=CC=C2C3=NNC(=S)C=C3)O

InChI

InChI=1S/C21H23N3O2S/c25-17(14-22-13-12-16-6-2-1-3-7-16)15-26-20-9-5-4-8-18(20)19-10-11-21(27)24-23-19/h1-11,17,22,25H,12-15H2,(H,24,27)