5-[[3-(2-methyl-5-propan-2-yl-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-pentyl-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[[3-(2-methyl-5-propan-2-yl-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-pentyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[[3-(5-isopropyl-2-methyl-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-pentyl-2-thioxo-thiazolidin-4-one CAS Name: 5-[[3-(2-methyl-5-propan-2-ylphenyl)-1-phenyl-4-pyrazolyl]methylidene]-3-pentyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[3-(2-methyl-5-propan-2-ylphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-pentyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-amyl-5-[[3-(5-isopropyl-2-methyl-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-2-thioxo-thiazolidin-4-one Formula: C28H31N3OS2 MolecularWeight: 489.69524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C(=CC2=CN(N=C2C3=C(C=CC(=C3)C(C)C)C)C4=CC=CC=C4)SC1=S

Isomeric SMILES

CCCCCN1C(=O)C(=CC2=CN(N=C2C3=C(C=CC(=C3)C(C)C)C)C4=CC=CC=C4)SC1=S

InChI

InChI=1S/C28H31N3OS2/c1-5-6-10-15-30-27(32)25(34-28(30)33)17-22-18-31(23-11-8-7-9-12-23)29-26(22)24-16-21(19(2)3)14-13-20(24)4/h7-9,11-14,16-19H,5-6,10,15H2,1-4H3