Vitas-M small molecule compound

(2E)-2-[4-(1,3-benzodioxol-5-ylamino)-4-oxobutan-2-ylidene]hydrazinecarboxamide

Catalog ID
STK119035
SMILES O=C(C/C(=N/NC(=O)N)/C)Nc1ccc2c(c1)OCO2

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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 C12H14N4O4 MW 278.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N4O4/c1-7(15-16-12(13)18)4-11(17)14-8-2-3-9-10(5-8)20-6-19-9/h2-3,5H,4,6H2,1H3,(H,14,17)(H3,13,16,18)/b15-7+
InChIKey
ANYZXBGMYGNNNQ-VIZOYTHASA-N
Synonyms

(2E)2(4(13BENZODIOXOL5YLAMINO)4OXOBUTAN2YLIDENE)HYDRAZINECARBOXAMIDE
(3E)N(13benzodioxol5yl)3(carbamoylhydrazinylidene)butanamide
CC(=NNC(=O)N)CC(=O)NC1=CC2=C(C=C1)OCO2
InChI=1SC12H14N4O4c17(151612(13)18)411(17)14823910(58)206199h235H46H21H3(H1417)(H3131618)b157+
MFCD00494998
O=C(CC(=NNC(=O)N)C)Nc1ccc2c(c1)OCO2
ZINC000101547077
ZINC101547080

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Available files

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