Vitas-M small molecule compound

2-(methylsulfanyl)-N'-(4-nitrophenyl)pyrimidine-5-carbohydrazide

Catalog ID
STK220212
SMILES CSc1ncc(cn1)C(=O)NNc1ccc(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 C12H11N5O3S MW 305.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N5O3S/c1-21-12-13-6-8(7-14-12)11(18)16-15-9-2-4-10(5-3-9)17(19)20/h2-7,15H,1H3,(H,16,18)
InChIKey
XDDCJEMIPURRAS-UHFFFAOYSA-N
Synonyms

2(methylsulfanyl)N(4nitrophenyl)pyrimidine5carbohydrazide
2METHYLSULFANYLN(4NITROPHENYL)PYRIMIDINE5CARBOHYDRAZIDE
CSC1=NC=C(C=N1)C(=O)NNC2=CC=C(C=C2)(N+)(=O)(O)
CSc1ncc(cn1)C(=O)NNc1ccc(cc1)(N+)(=O)(O)
InChI=1SC12H11N5O3Sc121121368(71412)11(18)161592410(539)17(19)20h2715H1H3(H1618)
MFCD08676799
ZINC000004815348
ZINC04815348
ZINC4815348

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.