Vitas-M small molecule compound
methyl 4-({[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonothioyl}amino)-3-phenylbutanoate
Catalog ID
STL536911
SMILES COC(=O)CC(c1ccccc1)CNC(=S)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C23H27N3O3S MW 425.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O3S/c1-29-22(28)11-18(17-6-3-2-4-7-17)12-24-23(30)25-13-16-10-19(15-25)20-8-5-9-21(27)26(20)14-16/h2-9,16,18-19H,10-15H2,1H3,(H,24,30)/t16-,18?,19+/m0/s1InChIKey
YCROBYNBHOLFOY-DDPXNHEPSA-NSynonyms
COC(=O)CC(c1ccccc1)CNC(=S)N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC23H27N3O3Sc12922(28)1118(176324717)122423(30)2513161019(1525)2085921(27)26(20)1416h29161819H1015H21H3(H2430)t1618?19+m0s1
methyl4((((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)carbonothioyl)amino)3phenylbutanoate
methyl4((1R5R)8oxo234568hexahydro1H15methanopyrido(12a)(15)diazocine3carbothioamido)3phenylbutanoate
MFCD05671284
ZINC000002109740
ZINC000002109742
Check stock
See real-time availability and sample size for STL536911 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.