Vitas-M small molecule compound

Catalog ID
STK586659
SMILES COc1ccc(c(c1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cccc1Cl)C(O)C)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 C22H24ClN3O5 MW 445.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN3O5/c1-11(27)16-10-14(20(28)24-17-9-12(30-2)7-8-18(17)31-3)22(26-16)13-5-4-6-15(23)19(13)25-21(22)29/h4-9,11,14,16,26-27H,10H2,1-3H3,(H,24,28)(H,25,29)/t11?,14-,16-,22+/m1/s1
InChIKey
JKEKAYBVKOGFEB-RTGIKRJCSA-N
Synonyms
1014042-08-0
(2R3S5R)7chloroN(25dimethoxyphenyl)5((R)1hydroxyethyl)2oxospiro(indoline32pyrrolidine)3carboxamide
(3R3S5R)7chloroN(25dimethoxyphenyl)5(1hydroxyethyl)2oxospiro(1Hindole32pyrrolidine)3carboxamide
1014042080
CC(C1CC(C2(N1)C3=C(C(=CC=C3)Cl)NC2=O)C(=O)NC4=C(C=CC(=C4)OC)OC)O
COc1ccc(c(c1)NC(=O)(C@H)1C(C@@H)(N(C@@)21C(=O)Nc1c2cccc1Cl)C(O)C)OC
InChI=1SC22H24ClN3O5c111(27)161014(20(28)2417912(302)7818(17)313)22(2616)1354615(23)19(13)2521(22)29h491114162627H10H213H3(H2428)(H2529)t11?141622+m1s1
MFCD10488253
ZINC000013591963
ZINC000057111347

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Available files

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