Vitas-M small molecule compound
(4S,7S)-4-(3,4-dichlorophenyl)-2-phenyl-7-(thiophen-2-yl)-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK334088
SMILES O=C1C[C@H](CC2=C1[C@H](c1ccc(c(c1)Cl)Cl)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 C26H19Cl2N3O2S MW 508.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19Cl2N3O2S/c27-17-9-8-14(11-18(17)28)22-23-19(12-15(13-20(23)32)21-7-4-10-34-21)29-25-24(22)26(33)31(30-25)16-5-2-1-3-6-16/h1-11,15,22,29-30H,12-13H2/t15-,22-/m0/s1InChIKey
NKMJAQULJHSORB-NYHFZMIOSA-NSynonyms
(4S7S)4(34dichlorophenyl)2phenyl7(thiophen2yl)4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
(4S7S)4(34dichlorophenyl)2phenyl7thiophen2yl146789hexahydropyrazolo(34b)quinoline35dione
C1C(CC(=O)C2=C1NC3=C(C2C4=CC(=C(C=C4)Cl)Cl)C(=O)N(N3)C5=CC=CC=C5)C6=CC=CS6
InChI=1SC26H19Cl2N3O2Sc27179814(1118(17)28)222319(1215(1320(23)32)2174103421)292524(22)26(33)31(3025)165213616h11115222930H1213H2t1522m0s1
MFCD13368677
O=C1C(C@H)(CC2=C1(C@H)(c1ccc(c(c1)Cl)Cl)c1c(N2)(nH)n(c1=O)c1ccccc1)c1cccs1
ZINC000018196879
ZINC18196879
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