2-(4-methylsulfanylphenyl)-5-(pyridin-3-ylmethyl)-4H-pyrazol-3-one

Systemtic Name: 2-(4-methylsulfanylphenyl)-5-(pyridin-3-ylmethyl)-4H-pyrazol-3-one Openeye Name: 2-(4-methylsulfanylphenyl)-5-(3-pyridylmethyl)-4H-pyrazol-3-one CAS Name: 2-[4-(methylthio)phenyl]-5-(3-pyridinylmethyl)-4H-pyrazol-3-one IUPAC Name: 2-(4-methylsulfanylphenyl)-5-(pyridin-3-ylmethyl)-4H-pyrazol-3-one Traditional Name: 2-[4-(methylthio)phenyl]-5-(3-pyridylmethyl)-2-pyrazolin-3-one Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2C(=O)CC(=N2)CC3=CN=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)N2C(=O)CC(=N2)CC3=CN=CC=C3

InChI

InChI=1S/C16H15N3OS/c1-21-15-6-4-14(5-7-15)19-16(20)10-13(18-19)9-12-3-2-8-17-11-12/h2-8,11H,9-10H2,1H3