Vitas-M small molecule compound
(E)-[2-(3-chlorophenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](3-methoxyphenyl)methanolate
Catalog ID
STL038703
SMILES COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Cl)Cc1ccc[nH+]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 C24H19ClN2O4 MW 434.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN2O4/c1-31-19-9-3-7-17(12-19)22(28)20-21(16-6-2-8-18(25)11-16)27(24(30)23(20)29)14-15-5-4-10-26-13-15/h2-13,21,28H,14H2,1H3/b22-20+InChIKey
IGYSWBCXRYOBPV-LSDHQDQOSA-NSynonyms
609312-94-9(4E)5(3CHLOROPHENYL)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)1(PYRIDIN3YLMETHYL)PYRROLIDINE23DIONE
(E)(2(3CHLOROPHENYL)45DIOXO1(PYRIDIN1IUM3YLMETHYL)PYRROLIDIN3YLIDENE)(3METHOXYPHENYL)METHANOLATE
(E)(2(3chlorophenyl)45dioxo1(pyridinium3ylmethyl)pyrrolidin3ylidene)(3methoxyphenyl)methanolate
609312949
COC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)CC3=CN=CC=C3)C4=CC(=CC=C4)Cl)O
COc1cccc(c1)C(=C1C(=O)C(=O)N(C1c1cccc(c1)Cl)Cc1ccc(nH+)c1)(O)
InChI=1SC24H19ClN2O4c1311993717(1219)22(28)2021(1662818(25)1116)27(24(30)23(20)29)14155410261315h2132128H14H21H3b2220+
MFCD18247688
ZINC000102863199
ZINC000102863204
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