Vitas-M small molecule compound
N-(4-chloro-2,5-dimethoxyphenyl)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
Catalog ID
STK626881
SMILES COc1cc(Cl)c(cc1NC(=O)c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1)OC
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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 C20H24ClN3O5S MW 453.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24ClN3O5S/c1-28-17-10-15(18(29-2)9-14(17)21)22-20(25)19-13-5-3-4-6-16(13)24(23-19)12-7-8-30(26,27)11-12/h9-10,12H,3-8,11H2,1-2H3,(H,22,25)InChIKey
OEAPRGXEVXNVRR-UHFFFAOYSA-NSynonyms
942719-54-2942719542
COC1=CC(=C(C=C1NC(=O)C2=NN(C3=C2CCCC3)C4CCS(=O)(=O)C4)OC)Cl
InChI=1SC20H24ClN3O5Sc128171015(18(292)914(17)21)2220(25)1913534616(13)24(2319)127830(2627)1112h91012H3811H212H3(H2225)
MFCD09857175
N(4chloro25dimethoxyphenyl)1(11dioxidotetrahydrothiophen3yl)4567tetrahydro1Hindazole3carboxamide
N(4chloro25dimethoxyphenyl)1(11dioxothiolan3yl)4567tetrahydroindazole3carboxamide
ZINC000013729252
ZINC000013729255
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