(5E)-3-heptyl-5-[[3-(7-methoxy-1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5E)-3-heptyl-5-[[3-(7-methoxy-1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5E)-3-heptyl-5-[[3-(7-methoxybenzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylene]-2-thioxo-thiazolidin-4-one CAS Name: (5E)-3-heptyl-5-[[3-(7-methoxy-2-benzofuranyl)-1-phenyl-4-pyrazolyl]methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5E)-3-heptyl-5-[[3-(7-methoxy-1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5E)-3-heptyl-5-[[3-(7-methoxybenzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylene]-2-thioxo-thiazolidin-4-one Formula: C29H29N3O3S2 MolecularWeight: 531.68886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=O)C(=CC2=CN(N=C2C3=CC4=C(O3)C(=CC=C4)OC)C5=CC=CC=C5)SC1=S

Isomeric SMILES

CCCCCCCN1C(=O)/C(=C\C2=CN(N=C2C3=CC4=C(O3)C(=CC=C4)OC)C5=CC=CC=C5)/SC1=S

InChI

InChI=1S/C29H29N3O3S2/c1-3-4-5-6-10-16-31-28(33)25(37-29(31)36)18-21-19-32(22-13-8-7-9-14-22)30-26(21)24-17-20-12-11-15-23(34-2)27(20)35-24/h7-9,11-15,17-19H,3-6,10,16H2,1-2H3/b25-18+