Vitas-M small molecule compound

N-[4-(2,5-dimethyl-3-{(E)-[1-(4-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-pyrrol-1-yl)phenyl]acetamide

Catalog ID
STK170570
SMILES CC(=O)Nc1ccc(cc1)n1c(C)cc(c1C)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)C

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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 C26H24N4O4 MW 456.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4O4/c1-15-5-9-22(10-6-15)30-25(33)23(24(32)28-26(30)34)14-19-13-16(2)29(17(19)3)21-11-7-20(8-12-21)27-18(4)31/h5-14H,1-4H3,(H,27,31)(H,28,32,34)/b23-14+
InChIKey
PPDKHWKISVBGJR-OEAKJJBVSA-N
Synonyms

(Z)N(4(25dimethyl3((246trioxo1(ptolyl)tetrahydropyrimidin5(2H)ylidene)methyl)1Hpyrrol1yl)phenyl)acetamide
CC(=O)Nc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)C
CC1=CC=C(C=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=C(C=C4)NC(=O)C)C)C(=O)NC2=O
InChI=1SC26H24N4O4c1155922(10615)3025(33)23(24(32)2826(30)34)14191316(2)29(17(19)3)2111720(81221)2718(4)31h514H14H3(H2731)(H283234)b2314+
MFCD01655819
N(4(25DIMETHYL3((E)(1(4METHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)PYRROL1YL)PHENYL)ACETAMIDE
N(4(25DIMETHYL3((E)(1(4METHYLPHENYL)246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)1HPYRROL1YL)PHENYL)ACETAMIDE
ZINC000001214602
ZINC01214602
ZINC1214602

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.