ethyl 1-(4-azanylsulfanylperoxyphenyl)-5H-isothiochromeno[4,3-c]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(4-azanylsulfanylperoxyphenyl)-5H-isothiochromeno[4,3-c]pyrazole-3-carboxylate Openeye Name: ethyl 1-(4-aminosulfanylperoxyphenyl)-5H-isothiochromeno[4,3-c]pyrazole-3-carboxylate CAS Name: 1-[4-(aminothio)dioxyphenyl]-5H-isothiochromeno[4,3-c]pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-aminosulfanylperoxyphenyl)-5H-isothiochromeno[4,3-c]pyrazole-3-carboxylate Traditional Name: 1-[4-(aminothio)peroxyphenyl]-5H-isothiochromeno[4,3-c]pyrazole-3-carboxylic acid ethyl ester Formula: C19H17N3O4S2 MolecularWeight: 415.48598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1SCC3=CC=CC=C32)C4=CC=C(C=C4)OOSN

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1SCC3=CC=CC=C32)C4=CC=C(C=C4)OOSN

InChI

InChI=1S/C19H17N3O4S2/c1-2-24-19(23)16-18-17(15-6-4-3-5-12(15)11-27-18)22(21-16)13-7-9-14(10-8-13)25-26-28-20/h3-10H,2,11,20H2,1H3