4-(3,5-dimethylpyrazol-1-yl)-2-(pyridin-2-ylmethylsulfanyl)-1H-imidazo[4,5-d]pyridazine

Systemtic Name: 4-(3,5-dimethylpyrazol-1-yl)-2-(pyridin-2-ylmethylsulfanyl)-1H-imidazo[4,5-d]pyridazine Openeye Name: 4-(3,5-dimethylpyrazol-1-yl)-2-(2-pyridylmethylsulfanyl)-1H-imidazo[4,5-d]pyridazine CAS Name: 4-(3,5-dimethyl-1-pyrazolyl)-2-(2-pyridinylmethylthio)-1H-imidazo[4,5-d]pyridazine IUPAC Name: 4-(3,5-dimethylpyrazol-1-yl)-2-(pyridin-2-ylmethylsulfanyl)-1H-imidazo[4,5-d]pyridazine Traditional Name: 4-(3,5-dimethylpyrazol-1-yl)-2-(2-pyridylmethylthio)-1H-imidazo[4,5-d]pyridazine Formula: C16H15N7S MolecularWeight: 337.4022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C3C(=CN=N2)NC(=N3)SCC4=CC=CC=N4)C

Isomeric SMILES

CC1=CC(=NN1C2=C3C(=CN=N2)NC(=N3)SCC4=CC=CC=N4)C

InChI

InChI=1S/C16H15N7S/c1-10-7-11(2)23(22-10)15-14-13(8-18-21-15)19-16(20-14)24-9-12-5-3-4-6-17-12/h3-8H,9H2,1-2H3,(H,19,20)