Vitas-M small molecule compound
(4R,7S)-7-(3,4-dimethoxyphenyl)-3-hydroxy-4-[4-(methylsulfanyl)phenyl]-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Catalog ID
STK334442
SMILES CSc1ccc(cc1)[C@H]1C2=C(C[C@@H](CC2=O)c2ccc(c(c2)OC)OC)Nc2c1c(O)n[nH]2
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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 C25H25N3O4S MW 463.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O4S/c1-31-19-9-6-14(12-20(19)32-2)15-10-17-22(18(29)11-15)21(13-4-7-16(33-3)8-5-13)23-24(26-17)27-28-25(23)30/h4-9,12,15,21H,10-11H2,1-3H3,(H3,26,27,28,30)/t15-,21-/m0/s1InChIKey
WDDOBDLYQHKDQS-BTYIYWSLSA-NSynonyms
(4R7S)7(34dimethoxyphenyl)3hydroxy4(4(methylsulfanyl)phenyl)146789hexahydro5Hpyrazolo(34b)quinolin5one
(4S7S)7(34dimethoxyphenyl)4(4methylsulfanylphenyl)246789hexahydro1Hpyrazolo(34b)quinoline35dione
COC1=C(C=C(C=C1)C2CC3=C(C(C4=C(N3)NNC4=O)C5=CC=C(C=C5)SC)C(=O)C2)OC
CSc1ccc(cc1)(C@H)1C2=C(C(C@@H)(CC2=O)c2ccc(c(c2)OC)OC)Nc2c1c(O)n(nH)2
InChI=1SC25H25N3O4Sc131199614(1220(19)322)15101722(18(29)1115)21(134716(333)8513)2324(2617)272825(23)30h49121521H1011H213H3(H326272830)t1521m0s1
MFCD13368725
ZINC000018197124
ZINC18197124
Check stock
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