Vitas-M small molecule compound
methyl 2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK398514
SMILES COC(=O)c1c(NC(=O)c2ccc3c(c2)OCO3)sc2c1CCC(C2)C(CC)(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 C23H27NO5S MW 429.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO5S/c1-5-23(2,3)14-7-8-15-18(11-14)30-21(19(15)22(26)27-4)24-20(25)13-6-9-16-17(10-13)29-12-28-16/h6,9-10,14H,5,7-8,11-12H2,1-4H3,(H,24,25)InChIKey
RZDNFAUHZUVSHY-UHFFFAOYSA-NSynonyms
CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC23H27NO5Sc1523(23)14781518(1114)3021(19(15)22(26)274)2420(25)13691617(1013)29122816h691014H5781112H214H3(H2425)
methyl2((13benzodioxol5ylcarbonyl)amino)6(2methylbutan2yl)4567tetrahydro1benzothiophene3carboxylate
methyl2(13benzodioxole5carbonylamino)6(2methylbutan2yl)4567tetrahydro1benzothiophene3carboxylate
MFCD03365476
ZINC000002745578
ZINC000002745579
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