Vitas-M small molecule compound

8-methyl-N'-[(E)-(4-nitrophenyl)methylidene]-6-oxo-3,4,9,9a-tetrahydro-2H,6H-pyrimido[2,1-b][1,3,4]thiadiazine-3-carbohydrazide

Catalog ID
STL440912
SMILES O=C(C1CSC2N(N1)C(=O)C=C(N2)C)N/N=C/c1ccc(cc1)[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 C15H16N6O4S MW 376.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N6O4S/c1-9-6-13(22)20-15(17-9)26-8-12(19-20)14(23)18-16-7-10-2-4-11(5-3-10)21(24)25/h2-7,12,15,17,19H,8H2,1H3,(H,18,23)/b16-7+
InChIKey
AOEFOAPBMUGSOQ-FRKPEAEDSA-N
Synonyms

8methylN((E)(4nitrophenyl)methylidene)6oxo3499atetrahydro2H6Hpyrimido(21b)(134)thiadiazine3carbohydrazide
8methylN((E)(4nitrophenyl)methylideneamino)6oxo3499atetrahydro2Hpyrimido(21b)(134)thiadiazine3carboxamide
CC1=CC(=O)N2C(N1)SCC(N2)C(=O)NN=CC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC15H16N6O4Sc19613(22)2015(179)26812(1920)14(23)18167102411(5310)21(24)25h2712151719H8H21H3(H1823)b167+
MFCD06243732
O=C(C1CSC2N(N1)C(=O)C=C(N2)C)NN=Cc1ccc(cc1)(N+)(=O)(O)
ZINC000033433989
ZINC000033433995

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Available files

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