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

Systemtic Name: 5-[[3-(3-butoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-cyclopentyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[[3-(3-butoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-cyclopentyl-2-thioxo-thiazolidin-4-one CAS Name: 5-[[3-(3-butoxyphenyl)-1-phenyl-4-pyrazolyl]methylidene]-3-cyclopentyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[3-(3-butoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-cyclopentyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-[[3-(3-butoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-cyclopentyl-2-thioxo-thiazolidin-4-one Formula: C28H29N3O2S2 MolecularWeight: 503.67876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C4CCCC4)C5=CC=CC=C5

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C4CCCC4)C5=CC=CC=C5

InChI

InChI=1S/C28H29N3O2S2/c1-2-3-16-33-24-15-9-10-20(17-24)26-21(19-30(29-26)22-11-5-4-6-12-22)18-25-27(32)31(28(34)35-25)23-13-7-8-14-23/h4-6,9-12,15,17-19,23H,2-3,7-8,13-14,16H2,1H3