Vitas-M small molecule compound

(2'S,3R,7a'S)-7-chloro-N-(2,5-dimethoxyphenyl)-2-oxo-1,1',2,2',5',6',7',7a'-octahydrospiro[indole-3,3'-pyrrolizine]-2'-carboxamide

Catalog ID
STK594084
SMILES COc1ccc(c(c1)NC(=O)[C@H]1C[C@H]2N([C@@]31C(=O)Nc1c3cccc1Cl)CCC2)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 C23H24ClN3O4 MW 441.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24ClN3O4/c1-30-14-8-9-19(31-2)18(12-14)25-21(28)16-11-13-5-4-10-27(13)23(16)15-6-3-7-17(24)20(15)26-22(23)29/h3,6-9,12-13,16H,4-5,10-11H2,1-2H3,(H,25,28)(H,26,29)/t13-,16+,23-/m0/s1
InChIKey
FDSIIYLSNZHBJC-LZDDTZTRSA-N
Synonyms
1014021-53-4
(2S3R7aS)7chloroN(25dimethoxyphenyl)2oxo11225677aoctahydrospiro(indole33pyrrolizine)2carboxamide
(2S3R7aS)7chloroN(25dimethoxyphenyl)2oxo125677ahexahydrospiro(indoline33pyrrolizine)2carboxamide
(2S3R8S)7chloroN(25dimethoxyphenyl)2oxospiro(125678hexahydropyrrolizine331Hindole)2carboxamide
1014021534
COC1=CC(=C(C=C1)OC)NC(=O)C2CC3CCCN3C24C5=C(C(=CC=C5)Cl)NC4=O
COc1ccc(c(c1)NC(=O)(C@H)1C(C@H)2N((C@@)31C(=O)Nc1c3cccc1Cl)CCC2)OC
InChI=1SC23H24ClN3O4c130148919(312)18(1214)2521(28)161113541027(13)23(16)1563717(24)20(15)2622(23)29h369121316H451011H212H3(H2528)(H2629)t1316+23m0s1
MFCD08284624
ZINC000057122060
ZINC57122060

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Available files

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