Vitas-M small molecule compound
7-chloro-4,6-dimethoxy-4'-{[2-(methoxymethyl)-1H-benzimidazol-5-yl]amino}-6'-methyl-2'H,3H-spiro[1-benzofuran-2,1'-cyclohex[3]ene]-2',3-dione
Catalog ID
STL550362
SMILES COCc1nc2c([nH]1)ccc(c2)NC1=CC(=O)C2(C(C1)C)Oc1c(C2=O)c(OC)cc(c1Cl)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 C25H24ClN3O6 MW 497.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN3O6/c1-12-7-14(27-13-5-6-15-16(8-13)29-20(28-15)11-32-2)9-19(30)25(12)24(31)21-17(33-3)10-18(34-4)22(26)23(21)35-25/h5-6,8-10,12,27H,7,11H2,1-4H3,(H,28,29)InChIKey
UMBJTYNAKFSXNN-UHFFFAOYSA-NSynonyms
(1S6R)7chloro46dimethoxy4((2(methoxymethyl)1Hbenzo(d)imidazol6yl)amino)6methyl3Hspiro(benzofuran21cyclohex(3)ene)23dione
132286117
7chloro46dimethoxy3((2(methoxymethyl)3~(H)benzimidazol5yl)amino)5methylspiro(1benzofuran26cyclohex2ene)13dione
7chloro46dimethoxy4((2(methoxymethyl)1Hbenzimidazol5yl)amino)6methyl2H3Hspiro(1benzofuran21cyclohex(3)ene)23dione
COCc1(nH)c2c(n1)ccc(c2)NC1=CC(=O)(C@)2((C@@H)(C1)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC
InChI=1SC25H24ClN3O6c112714(2713561516(813)2920(2815)11322)919(30)25(12)24(31)2117(333)1018(344)22(26)23(21)3525h568101227H711H214H3(H2829)
MFCD31757547
ZINC000524729446
ZINC000888089644
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