Vitas-M small molecule compound

1-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-methoxyphenyl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide

Catalog ID
STK629973
SMILES COc1ccc(cc1)NC(=O)c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1

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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 C19H23N3O4S MW 389.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O4S/c1-26-15-8-6-13(7-9-15)20-19(23)18-16-4-2-3-5-17(16)22(21-18)14-10-11-27(24,25)12-14/h6-9,14H,2-5,10-12H2,1H3,(H,20,23)
InChIKey
INLGZJQDQYYACV-UHFFFAOYSA-N
Synonyms
942676-85-9
1(11dioxidotetrahydrothiophen3yl)N(4methoxyphenyl)4567tetrahydro1Hindazole3carboxamide
1(11dioxothiolan3yl)N(4methoxyphenyl)4567tetrahydroindazole3carboxamide
942676859
COC1=CC=C(C=C1)NC(=O)C2=NN(C3=C2CCCC3)C4CCS(=O)(=O)C4
InChI=1SC19H23N3O4Sc126158613(7915)2019(23)1816423517(16)22(2118)14101127(2425)1214h6914H251012H21H3(H2023)
MFCD09854001
ZINC000013693193
ZINC000013693194

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.