Vitas-M small molecule compound
(2E)-2-cyano-3-{2,5-dimethyl-1-[4-(morpholin-4-yl)-3-nitrophenyl]-1H-pyrrol-3-yl}-N-(4-methoxyphenyl)prop-2-enamide
Catalog ID
STL000290
SMILES N#C/C(=C\c1cc(n(c1C)c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1)C)/C(=O)Nc1ccc(cc1)OC
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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 C27H27N5O5 MW 501.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O5/c1-18-14-20(15-21(17-28)27(33)29-22-4-7-24(36-3)8-5-22)19(2)31(18)23-6-9-25(26(16-23)32(34)35)30-10-12-37-13-11-30/h4-9,14-16H,10-13H2,1-3H3,(H,29,33)/b21-15+InChIKey
JCZDZXYDINPRDU-RCCKNPSSSA-NSynonyms
1164480-52-7(2E)2cyano3(25dimethyl1(4(morpholin4yl)3nitrophenyl)1Hpyrrol3yl)N(4methoxyphenyl)prop2enamide
(E)2CYANO3(25DIMETHYL1(4MORPHOLIN4YL3NITROPHENYL)1HPYRROL3YL)N(4METHOXYPHENYL)ACRYLAMIDE
(E)2CYANO3(25DIMETHYL1(4MORPHOLIN4YL3NITROPHENYL)PYRROL3YL)N(4METHOXYPHENYL)PROP2ENAMIDE
(E)2cyano3(25dimethyl1(4morpholino3nitrophenyl)1Hpyrrol3yl)N(4methoxyphenyl)acrylamide
1164480527
2CYANO3(1(3NITRO4(4MORPHOLINYL)PHENYL)25DIMETHYL1HPYRROL3YL)N(4METHOXYPHENYL)ACRYLAMIDE
CC1=CC(=C(N1C2=CC(=C(C=C2)N3CCOCC3)(N+)(=O)(O))C)C=C(C#N)C(=O)NC4=CC=C(C=C4)OC
InChI=1SC27H27N5O5c1181420(1521(1728)27(33)29224724(363)8522)19(2)31(18)236925(26(1623)32(34)35)30101237131130h491416H1013H213H3(H2933)b2115+
MFCD02904644
N#CC(=Cc1cc(n(c1C)c1ccc(c(c1)(N+)(=O)(O))N1CCOCC1)C)C(=O)Nc1ccc(cc1)OC
ZINC000008450434
ZINC08450434
ZINC8450434
Check stock
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Check stock on Vitas-MAvailable files
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