Vitas-M small molecule compound
(1'S,3R,3'S,7a'S)-6''-chloro-1'-[(2-ethoxyphenyl)carbonyl]-7''-methyl-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Catalog ID
STL532921
SMILES CCOc1ccccc1C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2ccc(c1C)Cl
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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 C31H28ClN3O4 MW 542.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28ClN3O4/c1-3-39-24-13-7-4-9-18(24)27(36)25-23-12-8-16-35(23)31(20-14-15-21(32)17(2)26(20)34-29(31)38)30(25)19-10-5-6-11-22(19)33-28(30)37/h4-7,9-11,13-15,23,25H,3,8,12,16H2,1-2H3,(H,33,37)(H,34,38)/t23-,25-,30+,31+/m0/s1InChIKey
MCVLICXOUXZAIZ-KDLQGFRMSA-NSynonyms
957021-27-1(1S3R3S7aS)6chloro1((2ethoxyphenyl)carbonyl)7methyl11225677aoctahydro1Hdispiro(indole32pyrrolizine33indole)22dione
(1S3R3S7aS)6chloro1((2ethoxyphenyl)carbonyl)7methyl5677atetrahydro1Hdispiro(indole32pyrrolizine33indole)22(1H1H)dione
(2~(S))2(((2~(S))2((1(23dihydro14benzodioxin6yl)5oxopyrrolidine3carbonyl)amino)propanoyl)amino)4methylpentanoicacid
16404570
957021271
CCOc1ccccc1C(=O)(C@@H)1(C@@H)2CCCN2(C@@)2((C@)31C(=O)Nc1c3cccc1)C(=O)Nc1c2ccc(c1C)Cl
InChI=1SC22H29N3O7c112(2)816(22(29)30)2420(27)13(3)2321(28)14919(26)25(1114)15451718(1015)32763117h4510121416H6911H213H3(H2328)(H2427)(H2930)t1314?16m0s1
MFCD06767480
ZINC000070700764
ZINC70700764
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.