Vitas-M small molecule compound
1,3-dimethyl-4-nitro-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)-1H-pyrazole-5-carboxamide
Catalog ID
STK306752
SMILES O=C(c1n(C)nc(c1[N+](=O)[O-])C)Nn1c(S)nc2c(c1=O)cccc2
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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 C14H12N6O4S MW 360.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N6O4S/c1-7-10(20(23)24)11(18(2)16-7)12(21)17-19-13(22)8-5-3-4-6-9(8)15-14(19)25/h3-6H,1-2H3,(H,15,25)(H,17,21)InChIKey
YILWNRMVIZJDEX-UHFFFAOYSA-NSynonyms
1005679-05-91005679059
13dimethyl4nitroN(4oxo2sulfanylquinazolin3(4H)yl)1Hpyrazole5carboxamide
25dimethyl4nitroN(4oxo2sulfanylidene1Hquinazolin3yl)pyrazole3carboxamide
CC1=NN(C(=C1(N+)(=O)(O))C(=O)NN2C(=O)C3=CC=CC=C3NC2=S)C
InChI=1SC14H12N6O4Sc1710(20(23)24)11(18(2)167)12(21)171913(22)853469(8)1514(19)25h36H12H3(H1525)(H1721)
MFCD04051111
O=C(c1n(C)nc(c1(N+)(=O)(O))C)Nn1c(S)nc2c(c1=O)cccc2
ZINC000102004394
ZINC102004394
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