Vitas-M small molecule compound

(5E)-5-{[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione

Catalog ID
STK177648
SMILES C#CCN1C(=O)S/C(=C/c2cccn2c2ccc(cc2)[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 C17H11N3O4S MW 353.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11N3O4S/c1-2-9-19-16(21)15(25-17(19)22)11-14-4-3-10-18(14)12-5-7-13(8-6-12)20(23)24/h1,3-8,10-11H,9H2/b15-11+
InChIKey
FWXYDSDSRKILCU-RVDMUPIBSA-N
Synonyms

(5E)5((1(4NITROPHENYL)1HPYRROL2YL)METHYLIDENE)3(PROP2YN1YL)13THIAZOLIDINE24DIONE
(5E)5((1(4NITROPHENYL)PYRROL2YL)METHYLIDENE)3PROP2YNYL13THIAZOLIDINE24DIONE
C#CCN1C(=O)C(=CC2=CC=CN2C3=CC=C(C=C3)(N+)(=O)(O))SC1=O
C#CCN1C(=O)SC(=Cc2cccn2c2ccc(cc2)(N+)(=O)(O))C1=O
InChI=1SC17H11N3O4Sc1291916(21)15(2517(19)22)1114431018(14)125713(8612)20(23)24h1381011H9H2b1511+
MFCD03728627
ZINC000004704653
ZINC04704653
ZINC4704653

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Available files

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