Vitas-M small molecule compound
N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(1-methyl-1H-benzimidazol-5-yl)glycinamide
Catalog ID
STL542598
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCC(=O)Nc2ccc3c(c2)ncn3C)NC(=O)C)cc(c1OC)OC
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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 C31H33N5O6 MW 571.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N5O6/c1-17(37)34-22-9-6-18-12-27(40-3)30(41-4)31(42-5)29(18)20-8-10-23(26(38)14-21(20)22)32-15-28(39)35-19-7-11-25-24(13-19)33-16-36(25)2/h7-8,10-14,16,22H,6,9,15H2,1-5H3,(H,32,38)(H,34,37)(H,35,39)/t22-/m0/s1InChIKey
WYNHCKVHQGAJFQ-QFIPXVFZSA-NSynonyms
1630916-47-0(S)2((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(1methyl1Hbenzo(d)imidazol5yl)acetamide
1630916470
2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(1methylbenzimidazol5yl)acetamide
91637827
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCC(=O)Nc2ccc3c(c2)ncn3C)NC(=O)C)cc(c1OC)OC
InChI=1SC31H33N5O6c117(37)342296181227(403)30(414)31(425)29(18)2081023(26(38)1421(20)22)321528(39)35197112524(1319)331636(25)2h7810141622H6915H215H3(H3238)(H3437)(H3539)t22m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(1methyl1Hbenzimidazol5yl)glycinamide
ZINC000217806411
ZINC217806411
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.