Vitas-M small molecule compound
(2E)-2-cyano-N-(3-ethoxyphenyl)-3-[1-(4-nitrophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]prop-2-enamide
Catalog ID
STK186466
SMILES CCOc1cccc(c1)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/c1-2-42-31-15-9-14-28(22-31)36-34(39)27(23-35)20-26-21-32(24-10-5-3-6-11-24)37(33(26)25-12-7-4-8-13-25)29-16-18-30(19-17-29)38(40)41/h3-22H,2H2,1H3,(H,36,39)/b27-20+InChIKey
SFOFCYALSLXKQK-NHFJDJAPSA-NSynonyms
(2E)2CYANON(3ETHOXYPHENYL)3(1(4NITROPHENYL)25DIPHENYL1HPYRROL3YL)PROP2ENAMIDE
(E)2cyanoN(3ethoxyphenyl)3(1(4nitrophenyl)25diphenylpyrrol3yl)prop2enamide
CCOC1=CC=CC(=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
CCOc1cccc(c1)NC(=O)C(=Cc1cc(n(c1c1ccccc1)c1ccc(cc1)(N+)(=O)(O))c1ccccc1)C#N
InChI=1SC34H26N4O4c1242311591428(2231)3634(39)27(2335)20262132(24105361124)37(33(26)25127481325)29161830(191729)38(40)41h322H2H21H3(H3639)b2720+
MFCD02193533
ZINC000100194613
ZINC100194613
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