Vitas-M small molecule compound

(5E)-5-[4-(2,4-dinitrophenoxy)benzylidene]-2-imino-1,3-thiazolidin-4-one

Catalog ID
STL407071
SMILES N=C1NC(=O)/C(=C\c2ccc(cc2)Oc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/S1

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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 C16H10N4O6S MW 386.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10N4O6S/c17-16-18-15(21)14(27-16)7-9-1-4-11(5-2-9)26-13-6-3-10(19(22)23)8-12(13)20(24)25/h1-8H,(H2,17,18,21)/b14-7+
InChIKey
QTAOODWFOKYZTG-VGOFMYFVSA-N
Synonyms

(5E)2AMINO5((4(24DINITROPHENOXY)PHENYL)METHYLIDENE)13THIAZOL4ONE
(5E)5(4(24dinitrophenoxy)benzylidene)2imino13thiazolidin4one
5((4(24DINITROPHENOXY)PHENYL)METHYLENE)2IMINO13THIAZOLIDIN4ONE
5(4(24BISNITROPHENOXY)BENZYLIDENE)2IMINO13THIAZOLIDIN4ONE
5(4(24DINITROPHENOXY)BENZYLIDENE)2IMINOTHIAZOLIDIN4ONE
C1=CC(=CC=C1C=C2C(=O)N=C(S2)N)OC3=C(C=C(C=C3)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC16H10N4O6Sc17161815(21)14(2716)791411(529)26136310(19(22)23)812(13)20(24)25h18H(H2171821)b147+
MFCD00652255
N=C1NC(=O)C(=Cc2ccc(cc2)Oc2ccc(cc2(N+)(=O)(O))(N+)(=O)(O))S1
ZINC000008435519
ZINC08435519
ZINC19927832
ZINC8435519

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Available files

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