Vitas-M small molecule compound
N-(5-chloro-2-methoxyphenyl)-4-methyl-3-nitro-N-{2-oxo-2-[(2E)-2-(pyridin-2-ylmethylidene)hydrazinyl]ethyl}benzenesulfonamide (non-preferred name)
Catalog ID
STL197657
SMILES COc1ccc(cc1N(S(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])C)CC(=O)N/N=C/c1ccccn1)Cl
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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 C22H20ClN5O6S MW 517.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN5O6S/c1-15-6-8-18(12-19(15)28(30)31)35(32,33)27(20-11-16(23)7-9-21(20)34-2)14-22(29)26-25-13-17-5-3-4-10-24-17/h3-13H,14H2,1-2H3,(H,26,29)/b25-13+InChIKey
DBCVFBSIFJRLHH-DHRITJCHSA-NSynonyms
2(5chloro2methoxyN(4methyl3nitrophenyl)sulfonylanilino)N((E)pyridin2ylmethylideneamino)acetamide
CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NN=CC2=CC=CC=N2)C3=C(C=CC(=C3)Cl)OC)(N+)(=O)(O)
COc1ccc(cc1N(S(=O)(=O)c1ccc(c(c1)(N+)(=O)(O))C)CC(=O)NN=Cc1ccccn1)Cl
InChI=1SC22H20ClN5O6Sc1156818(1219(15)28(30)31)35(3233)27(201116(23)7921(20)342)1422(29)26251317534102417h313H14H212H3(H2629)b2513+
MFCD02045128
N(5chloro2methoxyphenyl)4methyl3nitroN(2oxo2((2E)2(pyridin2ylmethylidene)hydrazinyl)ethyl)benzenesulfonamide(nonpreferredname)
ZINC000009056599
ZINC33927801
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