Vitas-M small molecule compound
(2E)-2-cyano-N-(4-ethoxyphenyl)-3-[1-(4-nitrophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]prop-2-enamide
Catalog ID
STK182362
SMILES CCOc1ccc(cc1)NC(=O)/C(=C/c1cc(n(c1c1ccccc1)c1ccc(cc1)[N+](=O)[O-])c1ccccc1)/C#N
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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 C34H26N4O4 MW 554.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H26N4O4/c1-2-42-31-19-13-28(14-20-31)36-34(39)27(23-35)21-26-22-32(24-9-5-3-6-10-24)37(33(26)25-11-7-4-8-12-25)29-15-17-30(18-16-29)38(40)41/h3-22H,2H2,1H3,(H,36,39)/b27-21+InChIKey
CZQLOPATSTWWRA-SZXQPVLSSA-NSynonyms
(2E)2CYANON(4ETHOXYPHENYL)3(1(4NITROPHENYL)25DIPHENYL1HPYRROL3YL)PROP2ENAMIDE
(E)2cyanoN(4ethoxyphenyl)3(1(4nitrophenyl)25diphenylpyrrol3yl)prop2enamide
CCOC1=CC=C(C=C1)NC(=O)C(=CC2=C(N(C(=C2)C3=CC=CC=C3)C4=CC=C(C=C4)(N+)(=O)(O))C5=CC=CC=C5)C#N
CCOc1ccc(cc1)NC(=O)C(=Cc1cc(n(c1c1ccccc1)c1ccc(cc1)(N+)(=O)(O))c1ccccc1)C#N
InChI=1SC34H26N4O4c124231191328(142031)3634(39)27(2335)21262232(2495361024)37(33(26)25117481225)29151730(181629)38(40)41h322H2H21H3(H3639)b2721+
MFCD02194641
ZINC000100196937
ZINC100196937
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