3-(1,3-benzodioxol-5-yl)-6-(pyridin-3-ylmethylsulfanyl)pyridazine

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-6-(pyridin-3-ylmethylsulfanyl)pyridazine Openeye Name: 3-(1,3-benzodioxol-5-yl)-6-(3-pyridylmethylsulfanyl)pyridazine CAS Name: 3-(1,3-benzodioxol-5-yl)-6-(3-pyridinylmethylthio)pyridazine IUPAC Name: 3-(1,3-benzodioxol-5-yl)-6-(pyridin-3-ylmethylsulfanyl)pyridazine Traditional Name: 3-(1,3-benzodioxol-5-yl)-6-(3-pyridylmethylthio)pyridazine Formula: C17H13N3O2S MolecularWeight: 323.36902

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NN=C(C=C3)SCC4=CN=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NN=C(C=C3)SCC4=CN=CC=C4

InChI

InChI=1S/C17H13N3O2S/c1-2-12(9-18-7-1)10-23-17-6-4-14(19-20-17)13-3-5-15-16(8-13)22-11-21-15/h1-9H,10-11H2