6-[(5E)-5-[[5-(3-nitrophenyl)thiophen-2-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate

Systemtic Name: 6-[(5E)-5-[[5-(3-nitrophenyl)thiophen-2-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Openeye Name: 6-[(5E)-5-[[5-(3-nitrophenyl)-2-thienyl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]hexanoate CAS Name: 6-[(5E)-5-[[5-(3-nitrophenyl)-2-thiophenyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]hexanoate IUPAC Name: 6-[(5E)-5-[[5-(3-nitrophenyl)thiophen-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Traditional Name: 6-[(5E)-4-keto-5-[[5-(3-nitrophenyl)-2-thienyl]methylene]-2-thioxo-thiazolidin-3-yl]hexanoate Formula: C20H17N2O5S3- MolecularWeight: 461.55438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(S2)C=C3C(=O)N(C(=S)S3)CCCCCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(S2)/C=C/3\C(=O)N(C(=S)S3)CCCCCC(=O)[O-]

InChI

InChI=1S/C20H18N2O5S3/c23-18(24)7-2-1-3-10-21-19(25)17(30-20(21)28)12-15-8-9-16(29-15)13-5-4-6-14(11-13)22(26)27/h4-6,8-9,11-12H,1-3,7,10H2,(H,23,24)/p-1/b17-12+