Vitas-M small molecule compound
(7S)-N-{(2S)-4-(methylsulfanyl)-1-oxo-1-[(tetrahydrofuran-2-ylmethyl)amino]butan-2-yl}-5-oxo-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indole-7-carboxamide
Catalog ID
STL531232
SMILES CSCC[C@@H](C(=O)NCC1CCCO1)NC(=O)[C@@H]1Cc2c(C3N1C(=O)c1c3cccc1)[nH]c1c2cccc1
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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 C29H32N4O4S MW 532.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O4S/c1-38-14-12-23(27(34)30-16-17-7-6-13-37-17)32-28(35)24-15-21-18-8-4-5-11-22(18)31-25(21)26-19-9-2-3-10-20(19)29(36)33(24)26/h2-5,8-11,17,23-24,26,31H,6-7,12-16H2,1H3,(H,30,34)(H,32,35)/t17?,23-,24-,26?/m0/s1InChIKey
VFAWLHPUAWSITG-XOWRHKRNSA-NSynonyms
956991-82-5(11~(S))~(N)((2~(S))4methylsulfanyl1oxo1(oxolan2ylmethylamino)butan2yl)9oxo1020diazapentacyclo(11700^(210)0^(38)0^(1419))icosa1(13)357141618heptaene11carboxamide
(7S)N((2S)4(methylsulfanyl)1oxo1((tetrahydrofuran2ylmethyl)amino)butan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
(7S)N((2S)4(methylthio)1oxo1(((tetrahydrofuran2yl)methyl)amino)butan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
16406314
956991825
InChI=1SC29H32N4O4Sc138141223(27(34)30161776133717)3228(35)241521188451122(18)3125(21)26199231020(19)29(36)33(24)26h258111723242631H671216H21H3(H3034)(H3235)t17?232426?m0s1
MFCD07637579
ZINC000038140289
ZINC000038140292
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.