Vitas-M small molecule compound

ethyl (4Z)-4-benzylidene-2-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK160317
SMILES CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccccc1)c1ccccc1

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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 C21H19NO3 MW 333.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO3/c1-3-25-21(24)19-15(2)22(17-12-8-5-9-13-17)20(23)18(19)14-16-10-6-4-7-11-16/h4-14H,3H2,1-2H3/b18-14-
InChIKey
KHZGUFKNFLJZEZ-JXAWBTAJSA-N
Synonyms

CCOC(=O)C1=C(C)N(C(=O)C1=Cc1ccccc1)c1ccccc1
CCOC(=O)C1=C(N(C(=O)C1=CC2=CC=CC=C2)C3=CC=CC=C3)C
ETHYL(4Z)4BENZYLIDENE2METHYL5OXO1PHENYL45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL(4Z)4BENZYLIDENE2METHYL5OXO1PHENYLPYRROLE3CARBOXYLATE
InChI=1SC21H19NO3c132521(24)1915(2)22(17128591317)20(23)18(19)1416106471116h414H3H212H3b1814
MFCD08671234
ZINC000014009209
ZINC14009209

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.