2-[(5Z)-4-oxidanylidene-5-[[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonate

Systemtic Name: 2-[(5Z)-4-oxidanylidene-5-[[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonate Openeye Name: 2-[(5Z)-4-oxo-5-[[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]methylene]-2-thioxo-thiazolidin-3-yl]ethanesulfonate CAS Name: 2-[(5Z)-4-oxo-5-[[1-phenyl-3-(3-propoxyphenyl)-4-pyrazolyl]methylidene]-2-sulfanylidene-3-thiazolidinyl]ethanesulfonate IUPAC Name: 2-[(5Z)-4-oxo-5-[[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonate Traditional Name: 2-[(5Z)-4-keto-5-[[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]methylene]-2-thioxo-thiazolidin-3-yl]ethanesulfonate Formula: C24H22N3O5S3- MolecularWeight: 528.64358

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCS(=O)(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CCCOC1=CC=CC(=C1)C2=NN(C=C2/C=C\3/C(=O)N(C(=S)S3)CCS(=O)(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C24H23N3O5S3/c1-2-12-32-20-10-6-7-17(14-20)22-18(16-27(25-22)19-8-4-3-5-9-19)15-21-23(28)26(24(33)34-21)11-13-35(29,30)31/h3-10,14-16H,2,11-13H2,1H3,(H,29,30,31)/p-1/b21-15-