Vitas-M small molecule compound
N-(1,3-benzothiazol-2-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide
Catalog ID
STK964565
SMILES COc1n[nH]c(c1[N+](=O)[O-])C(=O)Nc1nc2c(s1)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 C12H9N5O4S MW 319.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9N5O4S/c1-21-11-9(17(19)20)8(15-16-11)10(18)14-12-13-6-4-2-3-5-7(6)22-12/h2-5H,1H3,(H,15,16)(H,13,14,18)InChIKey
OQAUJRXHTUUBCV-UHFFFAOYSA-NSynonyms
515121-23-0515121230
COC1=NNC(=C1(N+)(=O)(O))C(=O)NC2=NC3=CC=CC=C3S2
COc1n(nH)c(c1(N+)(=O)(O))C(=O)Nc1nc2c(s1)cccc2
InChI=1SC12H9N5O4Sc121119(17(19)20)8(151611)10(18)141213642357(6)2212h25H1H3(H1516)(H131418)
MFCD03758096
N(13benzothiazol2yl)3methoxy4nitro1Hpyrazole5carboxamide
N(13BENZOTHIAZOL2YL)4NITRO3METHOXY1HPYRAZOLE5CARBOXAMIDE
ZINC000004631388
ZINC04631388
ZINC4631388
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