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

Systemtic Name: 4-[(5Z)-4-oxidanylidene-5-(quinoxalin-5-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: 4-[(5Z)-4-oxo-5-(quinoxalin-5-ylmethylene)-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5Z)-4-oxo-5-(5-quinoxalinylmethylidene)-2-sulfanylidene-3-thiazolidinyl]butanoate IUPAC Name: 4-[(5Z)-4-oxo-5-(quinoxalin-5-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5Z)-4-keto-5-(quinoxalin-5-ylmethylene)-2-thioxo-thiazolidin-3-yl]butyrate Formula: C16H12N3O3S2- MolecularWeight: 358.41478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)N=CC=N2)C=C3C(=O)N(C(=S)S3)CCCC(=O)[O-]

Isomeric SMILES

C1=CC(=C2C(=C1)N=CC=N2)/C=C\3/C(=O)N(C(=S)S3)CCCC(=O)[O-]

InChI

InChI=1S/C16H13N3O3S2/c20-13(21)5-2-8-19-15(22)12(24-16(19)23)9-10-3-1-4-11-14(10)18-7-6-17-11/h1,3-4,6-7,9H,2,5,8H2,(H,20,21)/p-1/b12-9-