Vitas-M small molecule compound
N-(1,1-dioxidotetrahydrothiophen-3-yl)-1-(2-ethoxyphenyl)-N,5-dimethyl-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STK952503
SMILES CCOc1ccccc1n1nnc(c1C)C(=O)N(C1CCS(=O)(=O)C1)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 C17H22N4O4S MW 378.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O4S/c1-4-25-15-8-6-5-7-14(15)21-12(2)16(18-19-21)17(22)20(3)13-9-10-26(23,24)11-13/h5-8,13H,4,9-11H2,1-3H3InChIKey
XNKKPMAZBRZACH-UHFFFAOYSA-NSynonyms
924819-23-8(1(2ETHOXYPHENYL)5METHYL(123TRIAZOL4YL))N(1HYDROXY1OXOTHIOLAN3YL)NMETHYLCARBOXAMIDE
924819238
CCOC1=CC=CC=C1N2C(=C(N=N2)C(=O)N(C)C3CCS(=O)(=O)C3)C
InChI=1SC17H22N4O4Sc142515865714(15)2112(2)16(181921)17(22)20(3)1391026(2324)1113h5813H4911H213H3
MFCD09760120
N(11dioxidotetrahydrothiophen3yl)1(2ethoxyphenyl)N5dimethyl1H123triazole4carboxamide
N(11dioxothiolan3yl)1(2ethoxyphenyl)N5dimethyltriazole4carboxamide
ZINC000011690477
ZINC000011690478
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