4,6-dimethyl-2-(2-oxidanylidenepropylsulfanyl)pyrazolo[1,5-a]pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-(2-oxidanylidenepropylsulfanyl)pyrazolo[1,5-a]pyridine-3-carbonitrile Openeye Name: 2-acetonylsulfanyl-4,6-dimethyl-pyrazolo[1,5-a]pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-2-(2-oxopropylthio)-3-pyrazolo[1,5-a]pyridinecarbonitrile IUPAC Name: 4,6-dimethyl-2-(2-oxopropylsulfanyl)pyrazolo[1,5-a]pyridine-3-carbonitrile Traditional Name: 2-(acetonylthio)-4,6-dimethyl-pyrazolo[1,5-a]pyridine-3-carbonitrile Formula: C13H13N3OS MolecularWeight: 259.32682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN2C1=C(C(=N2)SCC(=O)C)C#N)C

Isomeric SMILES

CC1=CC(=CN2C1=C(C(=N2)SCC(=O)C)C#N)C

InChI

InChI=1S/C13H13N3OS/c1-8-4-9(2)12-11(5-14)13(15-16(12)6-8)18-7-10(3)17/h4,6H,7H2,1-3H3