Vitas-M small molecule compound
(E)-{2-(4-fluorophenyl)-4,5-dioxo-1-[2-(piperazin-1-ium-1-yl)ethyl]pyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Catalog ID
STL043916
SMILES CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)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 C26H30FN3O4 MW 467.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30FN3O4/c1-17(2)34-21-9-5-19(6-10-21)24(31)22-23(18-3-7-20(27)8-4-18)30(26(33)25(22)32)16-15-29-13-11-28-12-14-29/h3-10,17,23,28,31H,11-16H2,1-2H3/b24-22+InChIKey
KZEXGMGZCMALTK-ZNTNEXAZSA-NSynonyms
371211-29-9(4E)5(4FLUOROPHENYL)4(HYDROXY(4PROPAN2YLOXYPHENYL)METHYLIDENE)1(2PIPERAZIN1YLETHYL)PYRROLIDINE23DIONE
(E)(2(4fluorophenyl)45dioxo1(2(piperazin1ium1yl)ethyl)pyrrolidin3ylidene)(4(propan2yloxy)phenyl)methanolate
(E)(2(4FLUOROPHENYL)45DIOXO1(2PIPERAZIN1IUM1YLETHYL)PYRROLIDIN3YLIDENE)(4PROPAN2YLOXYPHENYL)METHANOLATE
371211299
5(4FLUOROPHENYL)3HYDROXY4((4(METHYLETHOXY)PHENYL)CARBONYL)1(2PIPERAZINYLETHYL)3PYRROLIN2ONE
CC(C)OC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC(NH+)3CCNCC3)C4=CC=C(C=C4)F)(O)
CC(Oc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)F)CC(NH+)1CCNCC1)(O))C
InChI=1SC26H30FN3O4c117(2)34219519(61021)24(31)2223(183720(27)8418)30(26(33)25(22)32)161529131128121429h31017232831H1116H212H3b2422+
MFCD18248312
ZINC000102368798
ZINC000102368800
Check stock
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