Vitas-M small molecule compound
(E)-[4-(benzyloxy)-2-methylphenyl]{2-(3,4-dichlorophenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK559246
SMILES O=C1C(=O)/C(=C(\c2ccc(cc2C)OCc2ccccc2)/[O-])/C(N1CC[NH+]1CCOCC1)c1ccc(c(c1)Cl)Cl
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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 C31H30Cl2N2O5 MW 581.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30Cl2N2O5/c1-20-17-23(40-19-21-5-3-2-4-6-21)8-9-24(20)29(36)27-28(22-7-10-25(32)26(33)18-22)35(31(38)30(27)37)12-11-34-13-15-39-16-14-34/h2-10,17-18,28,36H,11-16,19H2,1H3/b29-27+InChIKey
GCISIQMRDSUNFR-ORIPQNMZSA-NSynonyms
(4E)5(34DICHLOROPHENYL)4(HYDROXY(2METHYL4PHENYLMETHOXYPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(2(34DICHLOROPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)(2METHYL4PHENYLMETHOXYPHENYL)METHANOLATE
(E)(4(benzyloxy)2methylphenyl)(2(34dichlorophenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)methanolate
4(4(BENZYLOXY)2METHYLBENZOYL)5(34DICHLOROPHENYL)3HYDROXY1(2MORPHOLINOETHYL)1HPYRROL2(5H)ONE
CC1=C(C=CC(=C1)OCC2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CCN4CCOCC4)C5=CC(=C(C=C5)Cl)Cl)O
InChI=1SC31H30Cl2N2O5c1201723(4019215324621)8924(20)29(36)2728(2271025(32)26(33)1822)35(31(38)30(27)37)121134131539161434h21017182836H111619H21H3b2927+
MFCD18243219
O=C1C(=O)C(=C(c2ccc(cc2C)OCc2ccccc2)(O))C(N1CC(NH+)1CCOCC1)c1ccc(c(c1)Cl)Cl
ZINC000102485436
ZINC000102485444
Check stock
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