Vitas-M small molecule compound
(4S,7S)-4-(2-chlorophenyl)-2-phenyl-7-(thiophen-2-yl)-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK334092
SMILES O=C1C[C@H](CC2=C1[C@H](c1ccccc1Cl)c1c(N2)[nH]n(c1=O)c1ccccc1)c1cccs1
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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 C26H20ClN3O2S MW 473.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20ClN3O2S/c27-18-10-5-4-9-17(18)22-23-19(13-15(14-20(23)31)21-11-6-12-33-21)28-25-24(22)26(32)30(29-25)16-7-2-1-3-8-16/h1-12,15,22,28-29H,13-14H2/t15-,22-/m0/s1InChIKey
FEHVPPPJQFKAQL-NYHFZMIOSA-NSynonyms
(4S7S)4(2chlorophenyl)2phenyl7(thiophen2yl)4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
(4S7S)4(2chlorophenyl)2phenyl7thiophen2yl146789hexahydropyrazolo(34b)quinoline35dione
C1C(CC(=O)C2=C1NC3=C(C2C4=CC=CC=C4Cl)C(=O)N(N3)C5=CC=CC=C5)C6=CC=CS6
InChI=1SC26H20ClN3O2Sc27181054917(18)222319(1315(1420(23)31)21116123321)282524(22)26(32)30(2925)167213816h11215222829H1314H2t1522m0s1
MFCD13368681
O=C1C(C@H)(CC2=C1(C@H)(c1ccccc1Cl)c1c(N2)(nH)n(c1=O)c1ccccc1)c1cccs1
ZINC000018196886
ZINC18196886
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