Vitas-M small molecule compound
(2E)-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STK116252
SMILES COCc1nnc(s1)NC(=O)/C=C/c1cccc(c1)[N+](=O)[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 C13H12N4O4S MW 320.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4O4S/c1-21-8-12-15-16-13(22-12)14-11(18)6-5-9-3-2-4-10(7-9)17(19)20/h2-7H,8H2,1H3,(H,14,16,18)/b6-5+InChIKey
YBWXOVTXINWHTQ-AATRIKPKSA-NSynonyms
669704-82-9(2E)N(5(METHOXYMETHYL)(134THIADIAZOL2YL))3(3NITROPHENYL)PROP2ENAMIDE
(2E)N(5(METHOXYMETHYL)134THIADIAZOL2YL)3(3NITROPHENYL)PROP2ENAMIDE
(E)N(5(METHOXYMETHYL)134THIADIAZOL2YL)3(3NITROPHENYL)PROP2ENAMIDE
669704829
COCC1=NN=C(S1)NC(=O)C=CC2=CC(=CC=C2)(N+)(=O)(O)
COCc1nnc(s1)NC(=O)C=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC13H12N4O4Sc121812151613(2212)1411(18)65932410(79)17(19)20h27H8H21H3(H141618)b65+
MFCD03993204
ZINC000000475965
ZINC00475965
ZINC475965
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