5-[[3-(2,5-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[[3-(2,5-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[[3-(2,5-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-phenethyl-2-thioxo-thiazolidin-4-one CAS Name: 5-[[3-(2,5-dimethylphenyl)-1-phenyl-4-pyrazolyl]methylidene]-3-phenethyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[3-(2,5-dimethylphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-[[3-(2,5-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-phenethyl-2-thioxo-thiazolidin-4-one Formula: C29H25N3OS2 MolecularWeight: 495.6583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H25N3OS2/c1-20-13-14-21(2)25(17-20)27-23(19-32(30-27)24-11-7-4-8-12-24)18-26-28(33)31(29(34)35-26)16-15-22-9-5-3-6-10-22/h3-14,17-19H,15-16H2,1-2H3