Vitas-M small molecule compound

3-[(5Z)-4-oxo-5-(quinoxalin-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid

Catalog ID
STK740898
SMILES OC(=O)CCN1C(=S)S/C(=C\c2cnc3c(n2)cccc3)/C1=O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C15H11N3O3S2 MW 345.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11N3O3S2/c19-13(20)5-6-18-14(21)12(23-15(18)22)7-9-8-16-10-3-1-2-4-11(10)17-9/h1-4,7-8H,5-6H2,(H,19,20)/b12-7-
InChIKey
QSRVOBYOSXUETN-GHXNOFRVSA-N
Synonyms
902033-32-3
(Z)3(4oxo5(quinoxalin2ylmethylene)2thioxothiazolidin3yl)propanoicacid
3((5Z)4OXO5(QUINOXALIN2YLMETHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
3((5Z)4oxo5(quinoxalin2ylmethylidene)2thioxo13thiazolidin3yl)propanoicacid
3(4OXO5(QUINOXALIN2YLMETHYLENE)2THIOXO13THIAZOLIDIN3YL)PROPANOICACID
902033323
C1=CC=C2C(=C1)N=CC(=N2)C=C3C(=O)N(C(=S)S3)CCC(=O)O
InChI=1SC15H11N3O3S2c1913(20)561814(21)12(2315(18)22)7981610312411(10)179h1478H56H2(H1920)b127
MFCD06784208
OC(=O)CCN1C(=S)SC(=Cc2cnc3c(n2)cccc3)C1=O
ZINC000006660251
ZINC6660251

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.