1-(3,4-dimethylphenyl)-4-methyl-7-(pyridin-3-ylmethylsulfanyl)pyrazolo[3,4-d]pyridazine

Systemtic Name: 1-(3,4-dimethylphenyl)-4-methyl-7-(pyridin-3-ylmethylsulfanyl)pyrazolo[3,4-d]pyridazine Openeye Name: 1-(3,4-dimethylphenyl)-4-methyl-7-(3-pyridylmethylsulfanyl)pyrazolo[3,4-d]pyridazine CAS Name: 1-(3,4-dimethylphenyl)-4-methyl-7-(3-pyridinylmethylthio)pyrazolo[3,4-d]pyridazine IUPAC Name: 1-(3,4-dimethylphenyl)-4-methyl-7-(pyridin-3-ylmethylsulfanyl)pyrazolo[3,4-d]pyridazine Traditional Name: 1-(3,4-dimethylphenyl)-4-methyl-7-(3-pyridylmethylthio)pyrazolo[3,4-d]pyridazine Formula: C20H19N5S MolecularWeight: 361.46336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NN=C3SCC4=CN=CC=C4)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NN=C3SCC4=CN=CC=C4)C)C

InChI

InChI=1S/C20H19N5S/c1-13-6-7-17(9-14(13)2)25-19-18(11-22-25)15(3)23-24-20(19)26-12-16-5-4-8-21-10-16/h4-11H,12H2,1-3H3