Vitas-M small molecule compound
methyl 2-({[4-(difluoromethoxy)-3-methoxyphenyl]carbonyl}amino)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK966382
SMILES COC(=O)c1c(NC(=O)c2ccc(c(c2)OC)OC(F)F)sc2c1CCC(C2)c1ccccc1
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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 C25H23F2NO5S MW 487.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23F2NO5S/c1-31-19-12-16(9-11-18(19)33-25(26)27)22(29)28-23-21(24(30)32-2)17-10-8-15(13-20(17)34-23)14-6-4-3-5-7-14/h3-7,9,11-12,15,25H,8,10,13H2,1-2H3,(H,28,29)InChIKey
SNUNYEFKAPWUBX-UHFFFAOYSA-NSynonyms
723253-68-7723253687
COC1=C(C=CC(=C1)C(=O)NC2=C(C3=C(S2)CC(CC3)C4=CC=CC=C4)C(=O)OC)OC(F)F
InChI=1SC25H23F2NO5Sc131191216(91118(19)3325(26)27)22(29)282321(24(30)322)1710815(1320(17)3423)146435714h37911121525H81013H212H3(H2829)
methyl2(((4(difluoromethoxy)3methoxyphenyl)carbonyl)amino)6phenyl4567tetrahydro1benzothiophene3carboxylate
methyl2((4(difluoromethoxy)3methoxybenzoyl)amino)6phenyl4567tetrahydro1benzothiophene3carboxylate
MFCD04048498
ZINC000002739354
ZINC000002739355
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