Vitas-M small molecule compound
methyl (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-methyl-5-oxo-1-[4-(propan-2-yl)phenyl]-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160044
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc2c(c1)OCO2)c1ccc(cc1)C(C)C
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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 C24H23NO5 MW 405.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23NO5/c1-14(2)17-6-8-18(9-7-17)25-15(3)22(24(27)28-4)19(23(25)26)11-16-5-10-20-21(12-16)30-13-29-20/h5-12,14H,13H2,1-4H3/b19-11-InChIKey
HSFOMELRDXXIRB-ODLFYWEKSA-NSynonyms
(Z)methyl4(benzo(d)(13)dioxol5ylmethylene)1(4isopropylphenyl)2methyl5oxo45dihydro1Hpyrrole3carboxylate
CC1=C(C(=CC2=CC3=C(C=C2)OCO3)C(=O)N1C4=CC=C(C=C4)C(C)C)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc2c(c1)OCO2)c1ccc(cc1)C(C)C
InChI=1SC24H23NO5c114(2)176818(9717)2515(3)22(24(27)284)19(23(25)26)11165102021(1216)30132920h51214H13H214H3b1911
METHYL(4Z)4(13BENZODIOXOL5YLMETHYLIDENE)2METHYL5OXO1(4(PROPAN2YL)PHENYL)45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4(13BENZODIOXOL5YLMETHYLIDENE)2METHYL5OXO1(4PROPAN2YLPHENYL)PYRROLE3CARBOXYLATE
MFCD01964188
ZINC000002305185
ZINC02305185
ZINC2305185
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