Vitas-M small molecule compound
(E)-{4,5-dioxo-2-phenyl-1-[2-(piperazin-1-ium-1-yl)ethyl]pyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Catalog ID
STK566145
SMILES CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)CC[NH+]1CCNCC1)/[O-])C
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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 C26H31N3O4 MW 449.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O4/c1-18(2)33-21-10-8-20(9-11-21)24(30)22-23(19-6-4-3-5-7-19)29(26(32)25(22)31)17-16-28-14-12-27-13-15-28/h3-11,18,23,27,30H,12-17H2,1-2H3/b24-22+InChIKey
CHDRNYYZSZEUHM-ZNTNEXAZSA-NSynonyms
371233-69-1(4E)4(HYDROXY(4PROPAN2YLOXYPHENYL)METHYLIDENE)5PHENYL1(2PIPERAZIN1YLETHYL)PYRROLIDINE23DIONE
(E)(45dioxo2phenyl1(2(piperazin1ium1yl)ethyl)pyrrolidin3ylidene)(4(propan2yloxy)phenyl)methanolate
(E)(45DIOXO2PHENYL1(2PIPERAZIN1IUM1YLETHYL)PYRROLIDIN3YLIDENE)(4PROPAN2YLOXYPHENYL)METHANOLATE
371233691
3HYDROXY4((4(METHYLETHOXY)PHENYL)CARBONYL)5PHENYL1(2PIPERAZINYLETHYL)3PYRROLIN2ONE
3HYDROXY5PHENYL1(2(PIPERAZIN1YL)ETHYL)4((4(PROPAN2YLOXY)PHENYL)CARBONYL)25DIHYDRO1HPYRROL2ONE
CC(C)OC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC(NH+)3CCNCC3)C4=CC=CC=C4)(O)
CC(Oc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccccc1)CC(NH+)1CCNCC1)(O))C
InChI=1SC26H31N3O4c118(2)332110820(91121)24(30)2223(196435719)29(26(32)25(22)31)171628141227131528h31118232730H1217H212H3b2422+
MFCD18244959
ZINC000102369045
ZINC000102369048
Check stock
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