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

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

CCC(C(=O)[O-])N1C(=O)C(=CC2=C(NN=C2)C3=CC=CC=C3)SC1=S

Isomeric SMILES

CC[C@H](C(=O)[O-])N1C(=O)/C(=C/C2=C(NN=C2)C3=CC=CC=C3)/SC1=S

InChI

InChI=1S/C17H15N3O3S2/c1-2-12(16(22)23)20-15(21)13(25-17(20)24)8-11-9-18-19-14(11)10-6-4-3-5-7-10/h3-9,12H,2H2,1H3,(H,18,19)(H,22,23)/p-1/b13-8-/t12-/m1/s1