Vitas-M small molecule compound
ethyl 4-(3-{(1E)-2-cyano-3-[(4-ethoxyphenyl)amino]-3-oxoprop-1-en-1-yl}-2,5-diphenyl-1H-pyrrol-1-yl)benzoate
Catalog ID
STK182353
SMILES CCOc1ccc(cc1)NC(=O)/C(=C/c1cc(n(c1c1ccccc1)c1ccc(cc1)C(=O)OCC)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 C37H31N3O4 MW 581.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H31N3O4/c1-3-43-33-21-17-31(18-22-33)39-36(41)30(25-38)23-29-24-34(26-11-7-5-8-12-26)40(35(29)27-13-9-6-10-14-27)32-19-15-28(16-20-32)37(42)44-4-2/h5-24H,3-4H2,1-2H3,(H,39,41)/b30-23+InChIKey
UCCYKKNDUOPYPY-JJKYIXSRSA-NSynonyms
CCOC1=CC=C(C=C1)NC(=O)C(=CC2=C(N(C(=C2)C3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OCC)C5=CC=CC=C5)C#N
CCOc1ccc(cc1)NC(=O)C(=Cc1cc(n(c1c1ccccc1)c1ccc(cc1)C(=O)OCC)c1ccccc1)C#N
ETHYL4(3((1E)2CYANO3((4ETHOXYPHENYL)AMINO)3OXOPROP1EN1YL)25DIPHENYL1HPYRROL1YL)BENZOATE
ethyl4(3((E)2cyano3(4ethoxyanilino)3oxoprop1enyl)25diphenylpyrrol1yl)benzoate
InChI=1SC37H31N3O4c134333211731(182233)3936(41)30(2538)23292434(26117581226)40(35(29)271396101427)32191528(162032)37(42)4442h524H34H212H3(H3941)b3023+
MFCD02194934
ZINC000097960705
ZINC97960705
Check stock
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