Vitas-M small molecule compound
methyl (4Z)-1-(4-fluorophenyl)-2-methyl-4-(4-nitrobenzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK161661
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)F
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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 C20H15FN2O5 MW 382.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15FN2O5/c1-12-18(20(25)28-2)17(11-13-3-7-16(8-4-13)23(26)27)19(24)22(12)15-9-5-14(21)6-10-15/h3-11H,1-2H3/b17-11-InChIKey
RHNCHLDEYVDGHB-BOPFTXTBSA-NSynonyms
CC1=C(C(=CC2=CC=C(C=C2)(N+)(=O)(O))C(=O)N1C3=CC=C(C=C3)F)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)(N+)(=O)(O))c1ccc(cc1)F
InChI=1SC20H15FN2O5c11218(20(25)282)17(11133716(8413)23(26)27)19(24)22(12)159514(21)61015h311H12H3b1711
METHYL(4Z)1(4FLUOROPHENYL)2METHYL4((4NITROPHENYL)METHYLIDENE)5OXOPYRROLE3CARBOXYLATE
METHYL(4Z)1(4FLUOROPHENYL)2METHYL4(4NITROBENZYLIDENE)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL1(4FLUOROPHENYL)5METHYL3((4NITROPHENYL)METHYLENE)2OXOAZOLINE4CARBOXYLATE
MFCD02217350
ZINC000000898004
ZINC00898004
ZINC898004
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