6-[(5E)-5-[(3-naphthalen-1-yl-2,1-benzoxazol-5-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid

Systemtic Name: 6-[(5E)-5-[(3-naphthalen-1-yl-2,1-benzoxazol-5-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Openeye Name: 6-[(5E)-5-[[3-(1-naphthyl)-2,1-benzoxazol-5-yl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]hexanoic acid CAS Name: 6-[(5E)-5-[[3-(1-naphthalenyl)-2,1-benzoxazol-5-yl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]hexanoic acid IUPAC Name: 6-[(5E)-5-[(3-naphthalen-1-yl-2,1-benzoxazol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Traditional Name: 6-[(5E)-4-keto-5-[[3-(1-naphthyl)anthranil-5-yl]methylene]-2-thioxo-thiazolidin-3-yl]hexanoic acid Formula: C27H22N2O4S2 MolecularWeight: 502.60458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=C4C=C(C=CC4=NO3)C=C5C(=O)N(C(=S)S5)CCCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=C4C=C(C=CC4=NO3)/C=C/5\C(=O)N(C(=S)S5)CCCCCC(=O)O

InChI

InChI=1S/C27H22N2O4S2/c30-24(31)11-2-1-5-14-29-26(32)23(35-27(29)34)16-17-12-13-22-21(15-17)25(33-28-22)20-10-6-8-18-7-3-4-9-19(18)20/h3-4,6-10,12-13,15-16H,1-2,5,11,14H2,(H,30,31)/b23-16+