Vitas-M small molecule compound
(3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one
Catalog ID
STL004360
SMILES COc1ccc(cc1)C(=O)/C=C\1/NCCNC1=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 C13H14N2O3 MW 246.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N2O3/c1-18-10-4-2-9(3-5-10)12(16)8-11-13(17)15-7-6-14-11/h2-5,8,14H,6-7H2,1H3,(H,15,17)/b11-8+InChIKey
UDQYKAJATPOXHR-DHZHZOJOSA-NSynonyms
(3E)3(2(4methoxyphenyl)2oxoethylidene)piperazin2one
(E)3(2(4methoxyphenyl)2oxoethylidene)piperazin2one
COC1=CC=C(C=C1)C(=O)C=C2C(=O)NCCN2
COc1ccc(cc1)C(=O)C=C1NCCNC1=O
InChI=1SC13H14N2O3c11810429(3510)12(16)81113(17)15761411h25814H67H21H3(H1517)b118+
MFCD00841468
ZINC000000261268
ZINC261268
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