Vitas-M small molecule compound
(5Z)-1-(4-methylphenyl)-5-{[1-(4-nitrophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK170296
SMILES Cc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cc(n(c2c2ccccc2)c2ccc(cc2)[N+](=O)[O-])c2ccccc2)/C1=O
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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 C34H24N4O5 MW 568.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H24N4O5/c1-22-12-14-27(15-13-22)37-33(40)29(32(39)35-34(37)41)20-25-21-30(23-8-4-2-5-9-23)36(31(25)24-10-6-3-7-11-24)26-16-18-28(19-17-26)38(42)43/h2-21H,1H3,(H,35,39,41)/b29-20-InChIKey
XRQAIQIJQHYQOR-BRPDVVIDSA-NSynonyms
(5Z)1(4METHYLPHENYL)5((1(4NITROPHENYL)25DIPHENYL1HPYRROL3YL)METHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
(5Z)1(4METHYLPHENYL)5((1(4NITROPHENYL)25DIPHENYLPYRROL3YL)METHYLIDENE)13DIAZINANE246TRIONE
CC1=CC=C(C=C1)N2C(=O)C(=CC3=C(N(C(=C3)C4=CC=CC=C4)C5=CC=C(C=C5)(N+)(=O)(O))C6=CC=CC=C6)C(=O)NC2=O
Cc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2cc(n(c2c2ccccc2)c2ccc(cc2)(N+)(=O)(O))c2ccccc2)C1=O
InChI=1SC34H24N4O5c122121427(151322)3733(40)29(32(39)3534(37)41)20252130(238425923)36(31(25)24106371124)26161828(191726)38(42)43h221H1H3(H353941)b2920
MFCD01541233
ZINC000100137035
ZINC100137035
Check stock
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Check stock on Vitas-MAvailable files
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