Vitas-M small molecule compound
(E)-{1-[3-(dimethylammonio)propyl]-2-(3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Catalog ID
STL147796
SMILES COc1cccc(c1)C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC(C)C)/[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 C26H32N2O5 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N2O5/c1-17(2)33-20-12-10-18(11-13-20)24(29)22-23(19-8-6-9-21(16-19)32-5)28(26(31)25(22)30)15-7-14-27(3)4/h6,8-13,16-17,23,29H,7,14-15H2,1-5H3/b24-22+InChIKey
YUQWSSNVUYHDAN-ZNTNEXAZSA-NSynonyms
371214-01-6(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(4PROPAN2YLOXYPHENYL)METHYLIDENE)5(3METHOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)2(3methoxyphenyl)45dioxopyrrolidin3ylidene)(4(propan2yloxy)phenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(3METHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4PROPAN2YLOXYPHENYL)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)3HYDROXY5(3METHOXYPHENYL)4((4(METHYLETHOXY)PHENYL)CARBONYL)3PYRROLIN2ONE
1(3(DIMETHYLAMINO)PROPYL)3HYDROXY5(3METHOXYPHENYL)4((4(PROPAN2YLOXY)PHENYL)CARBONYL)25DIHYDRO1HPYRROL2ONE
371214016
CC(C)OC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCC(NH+)(C)C)C3=CC(=CC=C3)OC)(O)
COc1cccc(c1)C1N(CCC(NH+)(C)C)C(=O)C(=O)C1=C(c1ccc(cc1)OC(C)C)(O)
InChI=1SC26H32N2O5c117(2)3320121018(111320)24(29)2223(1986921(1619)325)28(26(31)25(22)30)1571427(3)4h681316172329H71415H215H3b2422+
MFCD20755260
ZINC000102925393
ZINC000102925396
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