Vitas-M small molecule compound
N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]benzamide
Catalog ID
STL401833
SMILES COc1ccc2c(c1)sc(n2)NC(=O)c1ccccc1Cn1nc(cc1C)[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 C20H17N5O4S MW 423.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N5O4S/c1-12-9-18(25(27)28)23-24(12)11-13-5-3-4-6-15(13)19(26)22-20-21-16-8-7-14(29-2)10-17(16)30-20/h3-10H,11H2,1-2H3,(H,21,22,26)InChIKey
WCFOFSAGBHUQGG-UHFFFAOYSA-NSynonyms
1005594-41-11005594411
CC1=CC(=NN1CC2=CC=CC=C2C(=O)NC3=NC4=C(S3)C=C(C=C4)OC)(N+)(=O)(O)
COc1ccc2c(c1)sc(n2)NC(=O)c1ccccc1Cn1nc(cc1C)(N+)(=O)(O)
InChI=1SC20H17N5O4Sc112918(25(27)28)2324(12)1113534615(13)19(26)222021168714(292)1017(16)3020h310H11H212H3(H212226)
MFCD04051085
N(6methoxy13benzothiazol2yl)2((5methyl3nitro1Hpyrazol1yl)methyl)benzamide
N(6methoxy13benzothiazol2yl)2((5methyl3nitropyrazol1yl)methyl)benzamide
ZINC000002795651
ZINC02795651
ZINC2795651
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