Vitas-M small molecule compound
methyl 6-(2-methylbutan-2-yl)-2-[(2-phenoxybutanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK426778
SMILES CCC(C(=O)Nc1sc2c(c1C(=O)OC)CCC(C2)C(CC)(C)C)Oc1ccccc1
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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 C25H33NO4S MW 443.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33NO4S/c1-6-19(30-17-11-9-8-10-12-17)22(27)26-23-21(24(28)29-5)18-14-13-16(15-20(18)31-23)25(3,4)7-2/h8-12,16,19H,6-7,13-15H2,1-5H3,(H,26,27)InChIKey
WCPAZWGRICLSIZ-UHFFFAOYSA-NSynonyms
CCC(C(=O)NC1=C(C2=C(S1)CC(CC2)C(C)(C)CC)C(=O)OC)OC3=CC=CC=C3
InChI=1SC25H33NO4Sc1619(30171198101217)22(27)262321(24(28)295)18141316(1520(18)3123)25(34)72h8121619H671315H215H3(H2627)
methyl6(2methylbutan2yl)2((2phenoxybutanoyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6(2methylbutan2yl)2(2phenoxybutanoylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD01357623
ZINC000002741609
ZINC000002741612
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