2-[4-oxidanylidene-5-(quinoxalin-5-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioic acid

Systemtic Name: 2-[4-oxidanylidene-5-(quinoxalin-5-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioic acid Openeye Name: 2-[4-oxo-5-(quinoxalin-5-ylmethylene)-2-thioxo-thiazolidin-3-yl]butanedioic acid CAS Name: 2-[4-oxo-5-(5-quinoxalinylmethylidene)-2-sulfanylidene-3-thiazolidinyl]butanedioic acid IUPAC Name: 2-[4-oxo-5-(quinoxalin-5-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanedioic acid Traditional Name: 2-[4-keto-5-(quinoxalin-5-ylmethylene)-2-thioxo-thiazolidin-3-yl]succinic acid Formula: C16H11N3O5S2 MolecularWeight: 389.40564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)N=CC=N2)C=C3C(=O)N(C(=S)S3)C(CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C2C(=C1)N=CC=N2)C=C3C(=O)N(C(=S)S3)C(CC(=O)O)C(=O)O

InChI

InChI=1S/C16H11N3O5S2/c20-12(21)7-10(15(23)24)19-14(22)11(26-16(19)25)6-8-2-1-3-9-13(8)18-5-4-17-9/h1-6,10H,7H2,(H,20,21)(H,23,24)