2-[(5Z)-5-[[3-(2-methyl-5-propan-2-yl-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoate

Systemtic Name: 2-[(5Z)-5-[[3-(2-methyl-5-propan-2-yl-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoate Openeye Name: 2-[(5Z)-5-[[3-(5-isopropyl-2-methyl-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetate CAS Name: 2-[(5Z)-5-[[3-(2-methyl-5-propan-2-ylphenyl)-1-phenyl-4-pyrazolyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetate IUPAC Name: 2-[(5Z)-5-[[3-(2-methyl-5-propan-2-ylphenyl)-1-phenylpyrazol-4-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate Traditional Name: 2-[(5Z)-5-[[3-(5-isopropyl-2-methyl-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-4-keto-2-thioxo-thiazolidin-3-yl]acetate Formula: C25H22N3O3S2- MolecularWeight: 476.59048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)C)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)C)C2=NN(C=C2/C=C\3/C(=O)N(C(=S)S3)CC(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C25H23N3O3S2/c1-15(2)17-10-9-16(3)20(11-17)23-18(13-28(26-23)19-7-5-4-6-8-19)12-21-24(31)27(14-22(29)30)25(32)33-21/h4-13,15H,14H2,1-3H3,(H,29,30)/p-1/b21-12-