4-[(5Z)-5-[(E)-3-(4-nitrophenyl)prop-2-enylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate

Systemtic Name: 4-[(5Z)-5-[(E)-3-(4-nitrophenyl)prop-2-enylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: 4-[(5Z)-5-[(E)-3-(4-nitrophenyl)prop-2-enylidene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5Z)-5-[(E)-3-(4-nitrophenyl)prop-2-enylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoate IUPAC Name: 4-[(5Z)-5-[(E)-3-(4-nitrophenyl)prop-2-enylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5Z)-4-keto-5-[(E)-3-(4-nitrophenyl)prop-2-enylidene]-2-thioxo-thiazolidin-3-yl]butyrate Formula: C16H13N2O5S2- MolecularWeight: 377.41482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC=C2C(=O)N(C(=S)S2)CCCC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1/C=C/C=C\2/C(=O)N(C(=S)S2)CCCC(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O5S2/c19-14(20)5-2-10-17-15(21)13(25-16(17)24)4-1-3-11-6-8-12(9-7-11)18(22)23/h1,3-4,6-9H,2,5,10H2,(H,19,20)/p-1/b3-1+,13-4-