Vitas-M small molecule compound
(4S,7S)-4-(4-methoxyphenyl)-2-phenyl-7-(thiophen-2-yl)-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK334417
SMILES COc1ccc(cc1)[C@H]1C2=C(C[C@@H](CC2=O)c2cccs2)Nc2c1c(=O)n([nH]2)c1ccccc1
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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 C27H23N3O3S MW 469.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O3S/c1-33-19-11-9-16(10-12-19)23-24-20(14-17(15-21(24)31)22-8-5-13-34-22)28-26-25(23)27(32)30(29-26)18-6-3-2-4-7-18/h2-13,17,23,28-29H,14-15H2,1H3/t17-,23-/m0/s1InChIKey
UOMPQZZHXACFNH-SBUREZEXSA-NSynonyms
(4S7S)4(4methoxyphenyl)2phenyl7(thiophen2yl)4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
(4S7S)4(4methoxyphenyl)2phenyl7thiophen2yl146789hexahydropyrazolo(34b)quinoline35dione
COC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CS4)NC5=C2C(=O)N(N5)C6=CC=CC=C6
COc1ccc(cc1)(C@H)1C2=C(C(C@@H)(CC2=O)c2cccs2)Nc2c1c(=O)n((nH)2)c1ccccc1
InChI=1SC27H23N3O3Sc1331911916(101219)232420(1417(1521(24)31)2285133422)282625(23)27(32)30(2926)186324718h21317232829H1415H21H3t1723m0s1
MFCD13368703
ZINC000018197080
ZINC18197080
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