3-(pyridin-3-ylmethylsulfanyl)-6-(2,4,5-trimethylphenyl)pyridazine

Systemtic Name: 3-(pyridin-3-ylmethylsulfanyl)-6-(2,4,5-trimethylphenyl)pyridazine Openeye Name: 3-(3-pyridylmethylsulfanyl)-6-(2,4,5-trimethylphenyl)pyridazine CAS Name: 3-(3-pyridinylmethylthio)-6-(2,4,5-trimethylphenyl)pyridazine IUPAC Name: 3-(pyridin-3-ylmethylsulfanyl)-6-(2,4,5-trimethylphenyl)pyridazine Traditional Name: 3-(3-pyridylmethylthio)-6-(2,4,5-trimethylphenyl)pyridazine Formula: C19H19N3S MolecularWeight: 321.43926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=NN=C(C=C2)SCC3=CN=CC=C3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=NN=C(C=C2)SCC3=CN=CC=C3)C)C

InChI

InChI=1S/C19H19N3S/c1-13-9-15(3)17(10-14(13)2)18-6-7-19(22-21-18)23-12-16-5-4-8-20-11-16/h4-11H,12H2,1-3H3