N-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-2-pyridin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-2-pyridin-2-ylsulfanyl-ethanamide Openeye Name: N-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-(2-pyridylsulfanyl)acetamide CAS Name: N-[(E)-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylideneamino]-2-(2-pyridinylthio)acetamide IUPAC Name: N-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-2-pyridin-2-ylsulfanylacetamide Traditional Name: N-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-(2-pyridylthio)acetamide Formula: C18H16ClN5OS MolecularWeight: 385.87054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=O)CSC2=CC=CC=N2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC(=O)CSC2=CC=CC=N2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C18H16ClN5OS/c1-13-15(18(19)24(23-13)14-7-3-2-4-8-14)11-21-22-16(25)12-26-17-9-5-6-10-20-17/h2-11H,12H2,1H3,(H,22,25)/b21-11+