Vitas-M small molecule compound
3,5,5-trimethyl-4-[(E)-[(2E)-3-(5-nitrofuran-2-yl)prop-2-en-1-ylidene](oxido)-lambda~5~-azanyl]-1,3-thiazolidine-2-thione
Catalog ID
STK700237
SMILES [O-]/[N+](=C/C=C/c1ccc(o1)[N+](=O)[O-])/C1N(C)C(=S)SC1(C)C
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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 C13H15N3O4S2 MW 341.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O4S2/c1-13(2)11(14(3)12(21)22-13)15(17)8-4-5-9-6-7-10(20-9)16(18)19/h4-8,11H,1-3H3/b5-4+,15-8+InChIKey
XLGZOBVJNPYUNM-SPXDXPJOSA-NSynonyms
(E)3(5nitrofuran2yl)N(355trimethyl2sulfanylidene13thiazolidin4yl)prop2en1imineoxide
(E)355trimethylN((E)3(5nitrofuran2yl)allylidene)2thioxothiazolidin4amineoxide
(O)(N+)(=CC=Cc1ccc(o1)(N+)(=O)(O))C1N(C)C(=S)SC1(C)C
355trimethyl4((E)((2E)3(5nitrofuran2yl)prop2en1ylidene)(oxido)lambda~5~azanyl)13thiazolidine2thione
355TRIMETHYL4((E)((2E)3(5NITROFURAN2YL)PROP2EN1YLIDENE)(OXIDO)LAMBDA5AZANYL)13THIAZOLIDINE2THIONE
CC1(C(N(C(=S)S1)C)(N+)(=CC=CC2=CC=C(O2)(N+)(=O)(O))(O))C
InChI=1SC13H15N3O4S2c113(2)11(14(3)12(21)2213)15(17)84596710(209)16(18)19h4811H13H3b54+158+
MFCD01559599
ZINC000004785330
ZINC000013756102
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