5-[[3-(3-bromanyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-butyl-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[[3-(3-bromanyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-butyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[[3-(3-bromo-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-butyl-2-thioxo-thiazolidin-4-one CAS Name: 5-[[3-(3-bromo-4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methylidene]-3-butyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[3-(3-bromo-4-methoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-butyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-[[3-(3-bromo-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-butyl-2-thioxo-thiazolidin-4-one Formula: C24H22BrN3O2S2 MolecularWeight: 528.48438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OC)Br)C4=CC=CC=C4)SC1=S

Isomeric SMILES

CCCCN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OC)Br)C4=CC=CC=C4)SC1=S

InChI

InChI=1S/C24H22BrN3O2S2/c1-3-4-12-27-23(29)21(32-24(27)31)14-17-15-28(18-8-6-5-7-9-18)26-22(17)16-10-11-20(30-2)19(25)13-16/h5-11,13-15H,3-4,12H2,1-2H3