Vitas-M small molecule compound
methyl 3-nitro-5-({5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}carbamoyl)benzoate
Catalog ID
STK041180
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc1ncc(s1)S(=O)(=O)c1ccc(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 C18H12N4O9S2 MW 492.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12N4O9S2/c1-31-17(24)11-6-10(7-13(8-11)22(27)28)16(23)20-18-19-9-15(32-18)33(29,30)14-4-2-12(3-5-14)21(25)26/h2-9H,1H3,(H,19,20,23)InChIKey
BELSDSNHQZOKEA-UHFFFAOYSA-NSynonyms
349439-98-1349439981
COC(=O)C1=CC(=CC(=C1)C(=O)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)(N+)(=O)(O))(N+)(=O)(O)
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)Nc1ncc(s1)S(=O)(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC18H12N4O9S2c13117(24)11610(713(811)22(27)28)16(23)201819915(3218)33(2930)144212(3514)21(25)26h29H1H3(H192023)
METHYL3NITRO5((5((4NITROPHENYL)SULFONYL)13THIAZOL2YL)CARBAMOYL)BENZOATE
methyl3nitro5((5((4nitrophenyl)sulfonyl)thiazol2yl)carbamoyl)benzoate
METHYL3NITRO5((5(4NITROPHENYL)SULFONYL13THIAZOL2YL)CARBAMOYL)BENZOATE
METHYL3NITRO5(N(5((4NITROPHENYL)SULFONYL)(13THIAZOL2YL))CARBAMOYL)BENZOATE
MFCD02862229
STK041180
ZINC000002218974
ZINC02218974
ZINC2218974
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.