Vitas-M small molecule compound
propan-2-yl 2-[(2-phenoxybutanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK334572
SMILES CCC(C(=O)Nc1sc2c(c1C(=O)OC(C)C)CCCC2)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 C22H27NO4S MW 401.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO4S/c1-4-17(27-15-10-6-5-7-11-15)20(24)23-21-19(22(25)26-14(2)3)16-12-8-9-13-18(16)28-21/h5-7,10-11,14,17H,4,8-9,12-13H2,1-3H3,(H,23,24)InChIKey
NUCIYOSLQXSIIG-UHFFFAOYSA-NSynonyms
CCC(C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)OC(C)C)OC3=CC=CC=C3
InChI=1SC22H27NO4Sc1417(2715106571115)20(24)232119(22(25)2614(2)3)1612891318(16)2821h5710111417H4891213H213H3(H2324)
MFCD01358013
propan2yl2((2phenoxybutanoyl)amino)4567tetrahydro1benzothiophene3carboxylate
propan2yl2(2phenoxybutanoylamino)4567tetrahydro1benzothiophene3carboxylate
ZINC000002742278
ZINC000002742279
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