Vitas-M small molecule compound

(1'S,3R,3'S,7a'S)-5''-chloro-1'-[(2-methoxyphenyl)carbonyl]-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione

Catalog ID
STL530042
SMILES COc1ccccc1C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(Cl)cc1

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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 C29H24ClN3O4 MW 513.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24ClN3O4/c1-37-23-11-5-2-7-17(23)25(34)24-22-10-6-14-33(22)29(19-15-16(30)12-13-21(19)32-27(29)36)28(24)18-8-3-4-9-20(18)31-26(28)35/h2-5,7-9,11-13,15,22,24H,6,10,14H2,1H3,(H,31,35)(H,32,36)/t22-,24-,28+,29+/m0/s1
InChIKey
RPTAQXNILUAFLR-MHPNLKRKSA-N
Synonyms
956999-19-2
(1S3R3S7aS)5chloro1((2methoxyphenyl)carbonyl)11225677aoctahydro1Hdispiro(indole32pyrrolizine33indole)22dione
(1S3R3S7aS)5chloro1((2methoxyphenyl)carbonyl)5677atetrahydro1Hdispiro(indole32pyrrolizine33indole)22(1H1H)dione
(2~(R))4amino2((2(((2~(Z))2((25dimethoxyphenyl)methylidene)3oxo1benzofuran6yl)oxy)acetyl)amino)4oxobutanoicacid
(RZ)4AMINO2(2((2(25DIMETHOXYBENZYLIDENE)3OXO23DIHYDROBENZOFURAN6YL)OXY)ACETAMIDO)4OXOBUTANOICACID
16403931
956999192
COc1ccccc1C(=O)(C@@H)1(C@@H)2CCCN2(C@@)2((C@)31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(Cl)cc1
InChI=1SC23H22N2O9c131134617(322)12(713)81922(28)155314(918(15)3419)331121(27)2516(23(29)30)1020(24)26h3916H1011H212H3(H22426)(H2527)(H2930)b198t16m1s1
MFCD06765655
N2((((2Z)2(25DIMETHOXYBENZYLIDENE)3OXO23DIHYDRO1BENZOFURAN6YL)OXY)ACETYL)DASPARAGINE
ZINC000059485870
ZINC59485870

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Available files

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