Vitas-M small molecule compound
methyl (4Z)-1-(4-chlorophenyl)-4-(4-hydroxy-3-methoxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK362247
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(c(c1)OC)O)c1ccc(cc1)Cl
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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 C21H18ClNO5 MW 399.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClNO5/c1-12-19(21(26)28-3)16(10-13-4-9-17(24)18(11-13)27-2)20(25)23(12)15-7-5-14(22)6-8-15/h4-11,24H,1-3H3/b16-10-InChIKey
DTJNVQIJGTVLNT-YBEGLDIGSA-NSynonyms
CC1=C(C(=CC2=CC(=C(C=C2)O)OC)C(=O)N1C3=CC=C(C=C3)Cl)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(c(c1)OC)O)c1ccc(cc1)Cl
InChI=1SC21H18ClNO5c11219(21(26)283)16(10134917(24)18(1113)272)20(25)23(12)157514(22)6815h41124H13H3b1610
METHYL(4Z)1(4CHLOROPHENYL)4((4HYDROXY3METHOXYPHENYL)METHYLIDENE)2METHYL5OXOPYRROLE3CARBOXYLATE
METHYL(4Z)1(4CHLOROPHENYL)4(4HYDROXY3METHOXYBENZYLIDENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL1(4CHLOROPHENYL)3((4HYDROXY3METHOXYPHENYL)METHYLENE)5METHYL2OXOAZOLINE4CARBOXYLATE
MFCD01894014
ZINC000004524876
ZINC04524876
ZINC4524876
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