3-[(5E)-4-oxidanylidene-5-[[1-(phenylmethyl)pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate

Systemtic Name: 3-[(5E)-4-oxidanylidene-5-[[1-(phenylmethyl)pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Openeye Name: 3-[(5E)-5-[(1-benzylpyrazol-4-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoate CAS Name: 3-[(5E)-4-oxo-5-[[1-(phenylmethyl)-4-pyrazolyl]methylidene]-2-sulfanylidene-3-thiazolidinyl]propanoate IUPAC Name: 3-[(5E)-5-[(1-benzylpyrazol-4-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Traditional Name: 3-[(5E)-5-[(1-benzylpyrazol-4-yl)methylene]-4-keto-2-thioxo-thiazolidin-3-yl]propionate Formula: C17H14N3O3S2- MolecularWeight: 372.44136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C=C3C(=O)N(C(=S)S3)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)/C=C/3\C(=O)N(C(=S)S3)CCC(=O)[O-]

InChI

InChI=1S/C17H15N3O3S2/c21-15(22)6-7-20-16(23)14(25-17(20)24)8-13-9-18-19(11-13)10-12-4-2-1-3-5-12/h1-5,8-9,11H,6-7,10H2,(H,21,22)/p-1/b14-8+