Vitas-M small molecule compound
5-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-3-[(4-ethylphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
Catalog ID
STL192843
SMILES CCc1ccc(cc1)S(=O)(=O)c1nnn2c1nc(N1CCC3(CC1)OCCO3)c1c2ccs1
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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 C22H23N5O4S2 MW 485.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O4S2/c1-2-15-3-5-16(6-4-15)33(28,29)21-20-23-19(18-17(7-14-32-18)27(20)25-24-21)26-10-8-22(9-11-26)30-12-13-31-22/h3-7,14H,2,8-13H2,1H3InChIKey
QWJBEHVLGYQLPP-UHFFFAOYSA-NSynonyms
931324-60-65(14dioxa8azaspiro(45)dec8yl)3((4ethylphenyl)sulfonyl)thieno(23e)(123)triazolo(15a)pyrimidine
931324606
CCC1=CC=C(C=C1)S(=O)(=O)C2=C3N=C(C4=C(N3N=N2)C=CS4)N5CCC6(CC5)OCCO6
InChI=1SC22H23N5O4S2c12153516(6415)33(2829)21202319(1817(7143218)27(20)252421)2610822(91126)3012133122h3714H2813H21H3
MFCD14898943
ZINC000009116963
ZINC9116963
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