Vitas-M small molecule compound
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,4,5-triethoxybenzamide
Catalog ID
STK412437
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)Nc1sc2c(c1C#N)CCC(C2)C(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 C26H34N2O4S MW 470.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N2O4S/c1-7-30-20-12-16(13-21(31-8-2)23(20)32-9-3)24(29)28-25-19(15-27)18-11-10-17(26(4,5)6)14-22(18)33-25/h12-13,17H,7-11,14H2,1-6H3,(H,28,29)InChIKey
WTDFBPQKJNJIOQ-UHFFFAOYSA-NSynonyms
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C#N
InChI=1SC26H34N2O4Sc1730201216(1321(3182)23(20)3293)24(29)282519(1527)18111017(26(45)6)1422(18)3325h121317H71114H216H3(H2829)
MFCD01343138
N(6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)345triethoxybenzamide
ZINC000002093239
ZINC000002093241
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