Vitas-M small molecule compound
methyl (4Z)-2-methyl-4-(4-methylbenzylidene)-5-oxo-1-(pyridin-3-ylmethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK159998
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)C)Cc1cccnc1
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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 C21H20N2O3 MW 348.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O3/c1-14-6-8-16(9-7-14)11-18-19(21(25)26-3)15(2)23(20(18)24)13-17-5-4-10-22-12-17/h4-12H,13H2,1-3H3/b18-11-InChIKey
JWYXVPFRNPQQMV-WQRHYEAKSA-NSynonyms
CC1=CC=C(C=C1)C=C2C(=C(N(C2=O)CC3=CN=CC=C3)C)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)C)Cc1cccnc1
InChI=1SC21H20N2O3c1146816(9714)111819(21(25)263)15(2)23(20(18)24)13175410221217h412H13H213H3b1811
METHYL(4Z)2METHYL4((4METHYLPHENYL)METHYLIDENE)5OXO1(PYRIDIN3YLMETHYL)PYRROLE3CARBOXYLATE
METHYL(4Z)2METHYL4(4METHYLBENZYLIDENE)5OXO1(PYRIDIN3YLMETHYL)45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD01893844
ZINC000014009132
ZINC14009132
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