Vitas-M small molecule compound
(3S)-2-hydroxy-3-(2-oxo-2-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}ethyl)-3,4-dihydro-5H-1,4-benzodiazepin-5-one
Catalog ID
STK941008
SMILES OC1=Nc2ccccc2C(=O)N[C@H]1CC(=O)N1CCN(CC1)C/C=C/c1ccccc1
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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 C24H26N4O3 MW 418.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O3/c29-22(17-21-24(31)25-20-11-5-4-10-19(20)23(30)26-21)28-15-13-27(14-16-28)12-6-9-18-7-2-1-3-8-18/h1-11,21H,12-17H2,(H,25,31)(H,26,30)/b9-6+/t21-/m0/s1InChIKey
RRNFGGHRIFGMAA-JLXBBBJOSA-NSynonyms
(3S)2hydroxy3(2oxo2(4((2E)3phenylprop2en1yl)piperazin1yl)ethyl)34dihydro5H14benzodiazepin5one
(3S)3(2oxo2(4((E)3phenylprop2enyl)piperazin1yl)ethyl)34dihydro1H14benzodiazepine25dione
C1CN(CCN1CC=CC2=CC=CC=C2)C(=O)CC3C(=O)NC4=CC=CC=C4C(=O)N3
InChI=1SC24H26N4O3c2922(172124(31)252011541019(20)23(30)2621)28151327(141628)1269187213818h11121H1217H2(H2531)(H2630)b96+t21m0s1
MFCD18179683
OC1=Nc2ccccc2C(=O)N(C@H)1CC(=O)N1CCN(CC1)CC=Cc1ccccc1
ZINC000044919774
ZINC44919774
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