Vitas-M small molecule compound
(3Z)-3-{[2,5-dimethyl-1-(2-methyl-4-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-1-methyl-5-(morpholin-4-ylsulfonyl)-1,3-dihydro-2H-indol-2-one
Catalog ID
STL441582
SMILES O=C1N(C)c2c(/C/1=C/c1cc(n(c1C)c1ccc(cc1C)[N+](=O)[O-])C)cc(cc2)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/c1-17-13-21(31(33)34)5-7-25(17)30-18(2)14-20(19(30)3)15-24-23-16-22(6-8-26(23)28(4)27(24)32)38(35,36)29-9-11-37-12-10-29/h5-8,13-16H,9-12H2,1-4H3/b24-15-InChIKey
CCKCFKSMHZYCJS-IWIPYMOSSA-NSynonyms
(3Z)3((25dimethyl1(2methyl4nitrophenyl)1Hpyrrol3yl)methylidene)1methyl5(morpholin4ylsulfonyl)13dihydro2Hindol2one
(3Z)3((25DIMETHYL1(2METHYL4NITROPHENYL)PYRROL3YL)METHYLIDENE)1METHYL5MORPHOLIN4YLSULFONYLINDOL2ONE
CC1=CC(=C(N1C2=C(C=C(C=C2)(N+)(=O)(O))C)C)C=C3C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)N(C3=O)C
InChI=1SC27H28N4O6Sc1171321(31(33)34)5725(17)3018(2)1420(19(30)3)1524231622(6826(23)28(4)27(24)32)38(3536)2991137121029h581316H912H214H3b2415
MFCD05132848
O=C1N(C)c2c(C1=Cc1cc(n(c1C)c1ccc(cc1C)(N+)(=O)(O))C)cc(cc2)S(=O)(=O)N1CCOCC1
ZINC000008777667
ZINC8777667
Check stock
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