Vitas-M small molecule compound
[2-(1,3-benzodioxol-5-yl)quinolin-4-yl][4-(phenylsulfonyl)piperazin-1-yl]methanone
Catalog ID
STK459786
SMILES O=C(c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2)N1CCN(CC1)S(=O)(=O)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 C27H23N3O5S MW 501.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O5S/c31-27(29-12-14-30(15-13-29)36(32,33)20-6-2-1-3-7-20)22-17-24(28-23-9-5-4-8-21(22)23)19-10-11-25-26(16-19)35-18-34-25/h1-11,16-17H,12-15,18H2InChIKey
FYRUFAZCQCCKQA-UHFFFAOYSA-NSynonyms
(2(13benzodioxol5yl)quinolin4yl)(4(phenylsulfonyl)piperazin1yl)methanone
(4(BENZENESULFONYL)PIPERAZIN1YL)(2(13BENZODIOXOL5YL)QUINOLIN4YL)METHANONE
2(2HBENZO(34D)13DIOXOLEN5YL)(4QUINOLYL)4(PHENYLSULFONYL)PIPERAZINYLKETONE
C1CN(CCN1C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)S(=O)(=O)C6=CC=CC=C6
InChI=1SC27H23N3O5Sc3127(29121430(151329)36(3233)206213720)221724(2823954821(22)23)1910112526(1619)35183425h1111617H121518H2
MFCD06191980
ZINC000016392649
ZINC16392649
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