Vitas-M small molecule compound
(2Z)-3-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)-2-(3-nitrophenyl)prop-2-enenitrile
Catalog ID
STK201481
SMILES N#C/C(=C\c1cc(n(c1C)c1ccccc1)C)/c1cccc(c1)[N+](=O)[O-]
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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 C21H17N3O2 MW 343.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O2/c1-15-11-18(16(2)23(15)20-8-4-3-5-9-20)12-19(14-22)17-7-6-10-21(13-17)24(25)26/h3-13H,1-2H3/b19-12+InChIKey
FQTKXAQQHKJDRI-XDHOZWIPSA-NSynonyms
(2Z)3(25DIMETHYL1PHENYL1HPYRROL3YL)2(3NITROPHENYL)PROP2ENENITRILE
(Z)3(25DIMETHYL1PHENYLPYRROL3YL)2(3NITROPHENYL)PROP2ENENITRILE
CC1=CC(=C(N1C2=CC=CC=C2)C)C=C(C#N)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC21H17N3O2c1151118(16(2)23(15)208435920)1219(1422)17761021(1317)24(25)26h313H12H3b1912+
MFCD06622036
N#CC(=Cc1cc(n(c1C)c1ccccc1)C)c1cccc(c1)(N+)(=O)(O)
ZINC000001071283
ZINC01071283
ZINC1071283
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