Vitas-M small molecule compound
methyl (4Z)-4-(4-hydroxy-3-methoxybenzylidene)-1-[4-(methoxycarbonyl)phenyl]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK709852
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(c(c1)OC)O)c1ccc(cc1)C(=O)OC
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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 C23H21NO7 MW 423.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO7/c1-13-20(23(28)31-4)17(11-14-5-10-18(25)19(12-14)29-2)21(26)24(13)16-8-6-15(7-9-16)22(27)30-3/h5-12,25H,1-4H3/b17-11-InChIKey
SDZUMWRNXVKYBZ-BOPFTXTBSA-NSynonyms
896807-27-5(Z)methyl4(4hydroxy3methoxybenzylidene)1(4(methoxycarbonyl)phenyl)2methyl5oxo45dihydro1Hpyrrole3carboxylate
896807275
CC1=C(C(=CC2=CC(=C(C=C2)O)OC)C(=O)N1C3=CC=C(C=C3)C(=O)OC)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(c(c1)OC)O)c1ccc(cc1)C(=O)OC
InChI=1SC23H21NO7c11320(23(28)314)17(111451018(25)19(1214)292)21(26)24(13)168615(7916)22(27)303h51225H14H3b1711
METHYL(4Z)4((4HYDROXY3METHOXYPHENYL)METHYLIDENE)1(4METHOXYCARBONYLPHENYL)2METHYL5OXOPYRROLE3CARBOXYLATE
methyl(4Z)4(4hydroxy3methoxybenzylidene)1(4(methoxycarbonyl)phenyl)2methyl5oxo45dihydro1Hpyrrole3carboxylate
MFCD04397004
ZINC000002200631
ZINC02200631
ZINC2200631
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