Vitas-M small molecule compound
4-[(5Z)-5-(2-nitrobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]benzoic acid
Catalog ID
STK215717
SMILES OC(=O)c1ccc(cc1)N1C(=O)S/C(=C\c2ccccc2[N+](=O)[O-])/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 C17H10N2O6S MW 370.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H10N2O6S/c20-15-14(9-11-3-1-2-4-13(11)19(24)25)26-17(23)18(15)12-7-5-10(6-8-12)16(21)22/h1-9H,(H,21,22)/b14-9-InChIKey
JXGCEYLOTFRBKV-ZROIWOOFSA-NSynonyms
4((5Z)5((2NITROPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)BENZOICACID
4((5Z)5(2NITROBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)BENZOICACID
C1=CC=C(C(=C1)C=C2C(=O)N(C(=O)S2)C3=CC=C(C=C3)C(=O)O)(N+)(=O)(O)
InChI=1SC17H10N2O6Sc201514(911312413(11)19(24)25)2617(23)18(15)127510(6812)16(21)22h19H(H2122)b149
MFCD08671508
OC(=O)c1ccc(cc1)N1C(=O)SC(=Cc2ccccc2(N+)(=O)(O))C1=O
ZINC000004785162
ZINC4785162
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