Vitas-M small molecule compound
2-(5-chloro-2-phenoxyphenyl)-7,8-dimethoxy-3-thioxo-2,3,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-1(5H)-one
Catalog ID
STK207492
SMILES COc1cc2CN3C(Cc2cc1OC)C(=O)N(C3=S)c1cc(Cl)ccc1Oc1ccccc1
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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 C25H21ClN2O4S MW 480.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O4S/c1-30-22-11-15-10-20-24(29)28(25(33)27(20)14-16(15)12-23(22)31-2)19-13-17(26)8-9-21(19)32-18-6-4-3-5-7-18/h3-9,11-13,20H,10,14H2,1-2H3InChIKey
NKBYAQXNCTWVQQ-UHFFFAOYSA-NSynonyms
2(5chloro2phenoxyphenyl)78dimethoxy3sulfanylidene1010adihydro5Himidazo(15b)isoquinolin1one
2(5chloro2phenoxyphenyl)78dimethoxy3thioxo231010atetrahydroimidazo(15b)isoquinolin1(5H)one
COC1=C(C=C2CN3C(CC2=C1)C(=O)N(C3=S)C4=C(C=CC(=C4)Cl)OC5=CC=CC=C5)OC
InChI=1SC25H21ClN2O4Sc130221115102024(29)28(25(33)27(20)1416(15)1223(22)312)191317(26)8921(19)32186435718h39111320H1014H212H3
MFCD06755314
ZINC000008770465
ZINC000008770467
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