Vitas-M small molecule compound

2-(3-{(E)-[1-(4-ethoxyphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-1-yl)-N-(2-methoxyethyl)acetamide

Catalog ID
STL368194
SMILES COCCNC(=O)Cn1cc(c2c1cccc2)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)OCC

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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 C26H26N4O6 MW 490.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O6/c1-3-36-19-10-8-18(9-11-19)30-25(33)21(24(32)28-26(30)34)14-17-15-29(16-23(31)27-12-13-35-2)22-7-5-4-6-20(17)22/h4-11,14-15H,3,12-13,16H2,1-2H3,(H,27,31)(H,28,32,34)/b21-14+
InChIKey
QTVRWXXJMIOFTC-KGENOOAVSA-N
Synonyms

2(3((1(4ETHOXYPHENYL)246TRIOXO(13DIHYDROPYRIMIDIN5YLIDENE))METHYL)INDOLYL)N(2METHOXYETHYL)ACETAMIDE
2(3((E)(1(4ETHOXYPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)INDOL1YL)N(2METHOXYETHYL)ACETAMIDE
2(3((E)(1(4ethoxyphenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)1Hindol1yl)N(2methoxyethyl)acetamide
CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC(=O)NCCOC)C(=O)NC2=O
COCCNC(=O)Cn1cc(c2c1cccc2)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)OCC
InChI=1SC26H26N4O6c13361910818(91119)3025(33)21(24(32)2826(30)34)14171529(1623(31)271213352)22754620(17)22h4111415H3121316H212H3(H2731)(H283234)b2114+
MFCD02734776
ZINC000002993308
ZINC02993308
ZINC2993308

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Available files

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