Vitas-M small molecule compound

Catalog ID
STK610226
SMILES CCOC(=O)c1ccc(cc1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(C)cc1Cl)C(O)C

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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 C24H26ClN3O5 MW 471.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26ClN3O5/c1-4-33-22(31)14-5-7-15(8-6-14)26-21(30)17-11-19(13(3)29)28-24(17)16-9-12(2)10-18(25)20(16)27-23(24)32/h5-10,13,17,19,28-29H,4,11H2,1-3H3,(H,26,30)(H,27,32)/t13?,17-,19-,24+/m1/s1
InChIKey
IJCOBUVXPJVBMD-COLBVAIJSA-N
Synonyms
1014042-21-7
1014042217
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC(NC23C4=CC(=CC(=C4NC3=O)Cl)C)C(C)O
CCOC(=O)c1ccc(cc1)NC(=O)(C@H)1C(C@@H)(N(C@@)21C(=O)Nc1c2cc(C)cc1Cl)C(O)C
ethyl4(((3R3S5R)7chloro5(1hydroxyethyl)5methyl2oxospiro(1Hindole32pyrrolidine)3carbonyl)amino)benzoate
ethyl4((2R3S5R)7chloro5((S)1hydroxyethyl)5methyl2oxospiro(indoline32pyrrolidin)3ylcarboxamido)benzoate
InChI=1SC24H26ClN3O5c143322(31)145715(8614)2621(30)171119(13(3)29)2824(17)16912(2)1018(25)20(16)2723(24)32h5101317192829H411H213H3(H2630)(H2732)t13?171924+m1s1
MFCD10488343
ZINC000009130350
ZINC000013592228

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.