Vitas-M small molecule compound
methyl (4Z)-1-(2-chlorophenyl)-2-methyl-4-(4-methylbenzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK161446
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)C)c1ccccc1Cl
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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 C21H18ClNO3 MW 367.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClNO3/c1-13-8-10-15(11-9-13)12-16-19(21(25)26-3)14(2)23(20(16)24)18-7-5-4-6-17(18)22/h4-12H,1-3H3/b16-12-InChIKey
DBOUYURYPXYFBD-VBKFSLOCSA-NSynonyms
CC1=CC=C(C=C1)C=C2C(=C(N(C2=O)C3=CC=CC=C3Cl)C)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)C)c1ccccc1Cl
InChI=1SC21H18ClNO3c11381015(11913)121619(21(25)263)14(2)23(20(16)24)18754617(18)22h412H13H3b1612
METHYL(4Z)1(2CHLOROPHENYL)2METHYL4((4METHYLPHENYL)METHYLIDENE)5OXOPYRROLE3CARBOXYLATE
METHYL(4Z)1(2CHLOROPHENYL)2METHYL4(4METHYLBENZYLIDENE)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD03253722
ZINC000014009495
ZINC14009495
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