4-[(5Z)-4-oxidanylidene-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate

Systemtic Name: 4-[(5Z)-4-oxidanylidene-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: 4-[(5Z)-4-oxo-5-[(5-phenyl-1H-pyrazol-4-yl)methylene]-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5Z)-4-oxo-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-3-thiazolidinyl]butanoate IUPAC Name: 4-[(5Z)-4-oxo-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5Z)-4-keto-5-[(5-phenyl-1H-pyrazol-4-yl)methylene]-2-thioxo-thiazolidin-3-yl]butyrate Formula: C17H14N3O3S2- MolecularWeight: 372.44136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=NN2)C=C3C(=O)N(C(=S)S3)CCCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=NN2)/C=C\3/C(=O)N(C(=S)S3)CCCC(=O)[O-]

InChI

InChI=1S/C17H15N3O3S2/c21-14(22)7-4-8-20-16(23)13(25-17(20)24)9-12-10-18-19-15(12)11-5-2-1-3-6-11/h1-3,5-6,9-10H,4,7-8H2,(H,18,19)(H,21,22)/p-1/b13-9-