Vitas-M small molecule compound
(2E)-N-(4-chlorophenyl)-2-cyano-3-[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]prop-2-enamide
Catalog ID
STK185305
SMILES N#C/C(=C\c1cc(n(c1C)c1cccc(c1)[N+](=O)[O-])C)/C(=O)Nc1ccc(cc1)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 C22H17ClN4O3 MW 420.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClN4O3/c1-14-10-16(15(2)26(14)20-4-3-5-21(12-20)27(29)30)11-17(13-24)22(28)25-19-8-6-18(23)7-9-19/h3-12H,1-2H3,(H,25,28)/b17-11+InChIKey
UHHSORZAVBVNSN-GZTJUZNOSA-NSynonyms
(2E)N(4CHLOROPHENYL)2CYANO3(25DIMETHYL1(3NITROPHENYL)1HPYRROL3YL)PROP2ENAMIDE
(E)N(4CHLOROPHENYL)2CYANO3(25DIMETHYL1(3NITROPHENYL)PYRROL3YL)PROP2ENAMIDE
CC1=CC(=C(N1C2=CC(=CC=C2)(N+)(=O)(O))C)C=C(C#N)C(=O)NC3=CC=C(C=C3)Cl
InChI=1SC22H17ClN4O3c1141016(15(2)26(14)2043521(1220)27(29)30)1117(1324)22(28)25198618(23)7919h312H12H3(H2528)b1711+
MFCD04543150
N#CC(=Cc1cc(n(c1C)c1cccc(c1)(N+)(=O)(O))C)C(=O)Nc1ccc(cc1)Cl
ZINC000002855127
ZINC02855127
ZINC2855127
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