Vitas-M small molecule compound
6-tert-butyl-N-(5-chloro-2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK431990
SMILES COc1cc(OC)c(cc1NC(=O)c1csc2c1CCC(C2)C(C)(C)C)Cl
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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 C21H26ClNO3S MW 407.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26ClNO3S/c1-21(2,3)12-6-7-13-14(11-27-19(13)8-12)20(24)23-16-9-15(22)17(25-4)10-18(16)26-5/h9-12H,6-8H2,1-5H3,(H,23,24)InChIKey
NDLFURRIRVNIFN-UHFFFAOYSA-NSynonyms
6tertbutylN(5chloro24dimethoxyphenyl)4567tetrahydro1benzothiophene3carboxamide
CC(C)(C)C1CCC2=C(C1)SC=C2C(=O)NC3=CC(=C(C=C3OC)OC)Cl
InChI=1SC21H26ClNO3Sc121(23)12671314(112719(13)812)20(24)2316915(22)17(254)1018(16)265h912H68H215H3(H2324)
MFCD03074959
ZINC000002754898
ZINC000002754899
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