Vitas-M small molecule compound
[(5E)-5-{[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STK040525
SMILES OC(=O)CN1C(=S)S/C(=C/c2cccn2c2cccc(c2)[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 C16H11N3O5S2 MW 389.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11N3O5S2/c20-14(21)9-18-15(22)13(26-16(18)25)8-11-5-2-6-17(11)10-3-1-4-12(7-10)19(23)24/h1-8H,9H2,(H,20,21)/b13-8+InChIKey
BDYOIRNCIOZFRL-MDWZMJQESA-NSynonyms
((5E)5((1(3NITROPHENYL)1HPYRROL2YL)METHYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
2((5E)5((1(3NITROPHENYL)PYRROL2YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
C1=CC(=CC(=C1)(N+)(=O)(O))N2C=CC=C2C=C3C(=O)N(C(=S)S3)CC(=O)O
InChI=1SC16H11N3O5S2c2014(21)91815(22)13(2616(18)25)81152617(11)1031412(710)19(23)24h18H9H2(H2021)b138+
MFCD03706535
OC(=O)CN1C(=S)SC(=Cc2cccn2c2cccc(c2)(N+)(=O)(O))C1=O
STK040525
ZINC000002990832
ZINC2990832
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