Vitas-M small molecule compound
N-(2-methyl-1,3-benzothiazol-6-yl)-3,5-dinitrobenzamide
Catalog ID
STK381933
SMILES Cc1nc2c(s1)cc(cc2)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[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 C15H10N4O5S MW 358.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H10N4O5S/c1-8-16-13-3-2-10(6-14(13)25-8)17-15(20)9-4-11(18(21)22)7-12(5-9)19(23)24/h2-7H,1H3,(H,17,20)InChIKey
DGZDRDPYCQTCLK-UHFFFAOYSA-NSynonyms
CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=CC(=C3)(N+)(=O)(O))(N+)(=O)(O)
Cc1nc2c(s1)cc(cc2)NC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC15H10N4O5Sc1816133210(614(13)258)1715(20)9411(18(21)22)712(59)19(23)24h27H1H3(H1720)
MFCD01932519
N(2methyl13benzothiazol6yl)35dinitrobenzamide
ZINC000004526179
ZINC04526179
ZINC4526179
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