1-(4-fluorophenyl)-4-propan-2-yl-7-(pyridin-3-ylmethylsulfanyl)pyrazolo[3,4-d]pyridazine

Systemtic Name: 1-(4-fluorophenyl)-4-propan-2-yl-7-(pyridin-3-ylmethylsulfanyl)pyrazolo[3,4-d]pyridazine Openeye Name: 1-(4-fluorophenyl)-4-isopropyl-7-(3-pyridylmethylsulfanyl)pyrazolo[3,4-d]pyridazine CAS Name: 1-(4-fluorophenyl)-4-propan-2-yl-7-(3-pyridinylmethylthio)pyrazolo[3,4-d]pyridazine IUPAC Name: 1-(4-fluorophenyl)-4-propan-2-yl-7-(pyridin-3-ylmethylsulfanyl)pyrazolo[3,4-d]pyridazine Traditional Name: 1-(4-fluorophenyl)-4-isopropyl-7-(3-pyridylmethylthio)pyrazolo[3,4-d]pyridazine Formula: C20H18FN5S MolecularWeight: 379.453823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(C2=C1C=NN2C3=CC=C(C=C3)F)SCC4=CN=CC=C4

Isomeric SMILES

CC(C)C1=NN=C(C2=C1C=NN2C3=CC=C(C=C3)F)SCC4=CN=CC=C4

InChI

InChI=1S/C20H18FN5S/c1-13(2)18-17-11-23-26(16-7-5-15(21)6-8-16)19(17)20(25-24-18)27-12-14-4-3-9-22-10-14/h3-11,13H,12H2,1-2H3