Vitas-M small molecule compound
4-(benzylsulfonyl)-N-(4-methoxyphenyl)-6-nitro-1-phenyl-1H-indazole-3-carboxamide
Catalog ID
STK679743
SMILES COc1ccc(cc1)NC(=O)c1nn(c2c1c(cc(c2)[N+](=O)[O-])S(=O)(=O)Cc1ccccc1)c1ccccc1
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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 C28H22N4O6S MW 542.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N4O6S/c1-38-23-14-12-20(13-15-23)29-28(33)27-26-24(31(30-27)21-10-6-3-7-11-21)16-22(32(34)35)17-25(26)39(36,37)18-19-8-4-2-5-9-19/h2-17H,18H2,1H3,(H,29,33)InChIKey
JGFSCNMXODOKJN-UHFFFAOYSA-NSynonyms
4(benzylsulfonyl)N(4methoxyphenyl)6nitro1phenyl1Hindazole3carboxamide
4BENZYLSULFONYLN(4METHOXYPHENYL)6NITRO1PHENYLINDAZOLE3CARBOXAMIDE
COC1=CC=C(C=C1)NC(=O)C2=NN(C3=CC(=CC(=C32)S(=O)(=O)CC4=CC=CC=C4)(N+)(=O)(O))C5=CC=CC=C5
COc1ccc(cc1)NC(=O)c1nn(c2c1c(cc(c2)(N+)(=O)(O))S(=O)(=O)Cc1ccccc1)c1ccccc1
InChI=1SC28H22N4O6Sc13823141220(131523)2928(33)272624(31(3027)21106371121)1622(32(34)35)1725(26)39(3637)18198425919h217H18H21H3(H2933)
MFCD03765917
N(4METHOXYPHENYL)1PHENYL4(BENZYLSULFONYL)6NITRO1HINDAZOLE3CARBOXAMIDE
ZINC000001072700
ZINC1072700
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