Vitas-M small molecule compound

ethyl (4Z)-1-(4-ethoxyphenyl)-4-[4-(methoxycarbonyl)benzylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK804803
SMILES CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)C(=O)OC)c1ccc(cc1)OCC

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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 C25H25NO6 MW 435.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO6/c1-5-31-20-13-11-19(12-14-20)26-16(3)22(25(29)32-6-2)21(23(26)27)15-17-7-9-18(10-8-17)24(28)30-4/h7-15H,5-6H2,1-4H3/b21-15-
InChIKey
TZOPYLFGTGECQN-QNGOZBTKSA-N
Synonyms

(Z)ethyl1(4ethoxyphenyl)4(4(methoxycarbonyl)benzylidene)2methyl5oxo45dihydro1Hpyrrole3carboxylate
CCOC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)C(=O)OC)c1ccc(cc1)OCC
CCOC1=CC=C(C=C1)N2C(=C(C(=CC3=CC=C(C=C3)C(=O)OC)C2=O)C(=O)OCC)C
ETHYL(4Z)1(4ETHOXYPHENYL)4((4METHOXYCARBONYLPHENYL)METHYLIDENE)2METHYL5OXOPYRROLE3CARBOXYLATE
ethyl(4Z)1(4ethoxyphenyl)4(4(methoxycarbonyl)benzylidene)2methyl5oxo45dihydro1Hpyrrole3carboxylate
InChI=1SC25H25NO6c153120131119(121420)2616(3)22(25(29)3262)21(23(26)27)15177918(10817)24(28)304h715H56H214H3b2115
MFCD01200002
ZINC000000842986
ZINC00842986
ZINC842986

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Available files

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