Vitas-M small molecule compound

ethyl 2-(4-chlorophenyl)-4-(2-hydroxyphenyl)-1,5,9-triazaspiro[5.5]undec-1-ene-9-carboxylate

Catalog ID
STL200372
SMILES CCOC(=O)N1CCC2(CC1)N=C(CC(N2)c1ccccc1O)c1ccc(cc1)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 C23H26ClN3O3 MW 427.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26ClN3O3/c1-2-30-22(29)27-13-11-23(12-14-27)25-19(16-7-9-17(24)10-8-16)15-20(26-23)18-5-3-4-6-21(18)28/h3-10,20,26,28H,2,11-15H2,1H3
InChIKey
MBRSEZSMLZBXCR-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCC2(CC1)NC(CC(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4O
ethyl2(4chlorophenyl)4(2hydroxyphenyl)159triazaspiro(55)undec1ene9carboxylate
ethyl4(4chlorophenyl)2(2hydroxyphenyl)159triazaspiro(55)undec4ene9carboxylate
InChI=1SC23H26ClN3O3c123022(29)27131123(121427)2519(167917(24)10816)1520(2623)18534621(18)28h310202628H21115H21H3
MFCD24858165
ZINC000080324894
ZINC000080324896

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Available files

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