Vitas-M small molecule compound
(3E)-3-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-1-ethyl-5-(morpholin-4-ylsulfonyl)-1,3-dihydro-2H-indol-2-one
Catalog ID
STL448701
SMILES CCN1C(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)[N+](=O)[O-])C)/c2c1ccc(c2)S(=O)(=O)N1CCOCC1
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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 C27H28N4O6S MW 536.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O6S/c1-4-29-26-10-9-23(38(35,36)28-11-13-37-14-12-28)17-24(26)25(27(29)32)16-20-15-18(2)30(19(20)3)21-5-7-22(8-6-21)31(33)34/h5-10,15-17H,4,11-14H2,1-3H3/b25-16+InChIKey
ZRJQIIXJJKLKNQ-PCLIKHOPSA-NSynonyms
(3E)3((25dimethyl1(4nitrophenyl)1Hpyrrol3yl)methylidene)1ethyl5(morpholin4ylsulfonyl)13dihydro2Hindol2one
(3E)3((25dimethyl1(4nitrophenyl)pyrrol3yl)methylidene)1ethyl5morpholin4ylsulfonylindol2one
CCN1C(=O)C(=Cc2cc(n(c2C)c2ccc(cc2)(N+)(=O)(O))C)c2c1ccc(c2)S(=O)(=O)N1CCOCC1
CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=CC4=C(N(C(=C4)C)C5=CC=C(C=C5)(N+)(=O)(O))C)C1=O
InChI=1SC27H28N4O6Sc14292610923(38(3536)28111337141228)1724(26)25(27(29)32)16201518(2)30(19(20)3)215722(8621)31(33)34h5101517H41114H213H3b2516+
MFCD05133801
ZINC000101377535
ZINC101377535
Check stock
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Check stock on Vitas-MAvailable files
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