ethyl (3Z)-5-methyl-3-[methylsulfanyl(nitroso)methylidene]-2-phenyl-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl (3Z)-5-methyl-3-[methylsulfanyl(nitroso)methylidene]-2-phenyl-1H-pyrazole-4-carboxylate Openeye Name: ethyl (3Z)-5-methyl-3-[methylsulfanyl(nitroso)methylene]-2-phenyl-1H-pyrazole-4-carboxylate CAS Name: (3Z)-5-methyl-3-[(methylthio)-nitrosomethylidene]-2-phenyl-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl (3Z)-5-methyl-3-[methylsulfanyl(nitroso)methylidene]-2-phenyl-1H-pyrazole-4-carboxylate Traditional Name: (5Z)-3-methyl-5-[(methylthio)-nitroso-methylene]-1-phenyl-3-pyrazoline-4-carboxylic acid ethyl ester Formula: C15H17N3O3S MolecularWeight: 319.37878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN(C1=C(N=O)SC)C2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C\1=C(NN(/C1=C(/N=O)\SC)C2=CC=CC=C2)C

InChI

InChI=1S/C15H17N3O3S/c1-4-21-15(19)12-10(2)16-18(11-8-6-5-7-9-11)13(12)14(17-20)22-3/h5-9,16H,4H2,1-3H3/b14-13-