ethyl (3Z)-3-[nitroso(sulfanyl)methylidene]-2,5-diphenyl-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl (3Z)-3-[nitroso(sulfanyl)methylidene]-2,5-diphenyl-1H-pyrazole-4-carboxylate Openeye Name: ethyl (3Z)-3-[nitroso(sulfanyl)methylene]-2,5-diphenyl-1H-pyrazole-4-carboxylate CAS Name: (3Z)-3-[mercapto(nitroso)methylidene]-2,5-diphenyl-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl (3Z)-3-[nitroso(sulfanyl)methylidene]-2,5-diphenyl-1H-pyrazole-4-carboxylate Traditional Name: (5Z)-5-[mercapto(nitroso)methylene]-1,3-diphenyl-3-pyrazoline-4-carboxylic acid ethyl ester Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN(C1=C(N=O)S)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C\1=C(NN(/C1=C(/N=O)\S)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H17N3O3S/c1-2-25-19(23)15-16(13-9-5-3-6-10-13)20-22(17(15)18(26)21-24)14-11-7-4-8-12-14/h3-12,20,26H,2H2,1H3/b18-17-