Vitas-M small molecule compound
2-(1,3-benzodioxol-5-yl)-N-[3-carbamoyl-5-(propan-2-yl)thiophen-2-yl]quinoline-4-carboxamide
Catalog ID
STK428831
SMILES O=C(c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2)Nc1sc(cc1C(=O)N)C(C)C
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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 C25H21N3O4S MW 459.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O4S/c1-13(2)22-11-17(23(26)29)25(33-22)28-24(30)16-10-19(27-18-6-4-3-5-15(16)18)14-7-8-20-21(9-14)32-12-31-20/h3-11,13H,12H2,1-2H3,(H2,26,29)(H,28,30)InChIKey
ZZIBIJOWXJPCJA-UHFFFAOYSA-NSynonyms
2((2(2HBENZO(34D)13DIOXOLEN5YL)(4QUINOLYL))CARBONYLAMINO)5(METHYLETHYL)THIOPHENE3CARBOXAMIDE
2(13benzodioxol5yl)N(3carbamoyl5(propan2yl)thiophen2yl)quinoline4carboxamide
2(13BENZODIOXOL5YL)N(3CARBAMOYL5PROPAN2YLTHIOPHEN2YL)QUINOLINE4CARBOXAMIDE
CC(C)C1=CC(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)C(=O)N
InChI=1SC25H21N3O4Sc113(2)221117(23(26)29)25(3322)2824(30)161019(2718643515(16)18)14782021(914)32123120h31113H12H212H3(H22629)(H2830)
MFCD03233273
ZINC000001002732
ZINC01002732
ZINC1002732
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