Vitas-M small molecule compound
2-(3-{(E)-[1-(4-methoxyphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-indol-1-yl)-N-phenylacetamide
Catalog ID
STL058269
SMILES COc1ccc(cc1)N1C(=NC(=O)/C(=C\c2cn(c3c2cccc3)CC(=O)Nc2ccccc2)/C1=O)S
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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 C28H22N4O4S MW 510.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N4O4S/c1-36-21-13-11-20(12-14-21)32-27(35)23(26(34)30-28(32)37)15-18-16-31(24-10-6-5-9-22(18)24)17-25(33)29-19-7-3-2-4-8-19/h2-16H,17H2,1H3,(H,29,33)(H,30,34,37)/b23-15+InChIKey
YSUUSYIAJLUMCN-HZHRSRAPSA-NSynonyms
2(3((E)(1(4methoxyphenyl)46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)1Hindol1yl)Nphenylacetamide
2(3((E)(1(4METHOXYPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)INDOL1YL)NPHENYLACETAMIDE
COc1ccc(cc1)N1C(=NC(=O)C(=Cc2cn(c3c2cccc3)CC(=O)Nc2ccccc2)C1=O)S
InChI=1SC28H22N4O4Sc13621131120(121421)3227(35)23(26(34)3028(32)37)15181631(241065922(18)24)1725(33)29197324819h216H17H21H3(H2933)(H303437)b2315+
MFCD08735966
ZINC000008743210
ZINC8743210
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