Vitas-M small molecule compound
methyl 6-tert-butyl-2-{[2-(2,5-dichlorophenoxy)propanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK731433
SMILES COC(=O)c1c(NC(=O)C(Oc2cc(Cl)ccc2Cl)C)sc2c1CCC(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 C23H27Cl2NO4S MW 484.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27Cl2NO4S/c1-12(30-17-11-14(24)7-9-16(17)25)20(27)26-21-19(22(28)29-5)15-8-6-13(23(2,3)4)10-18(15)31-21/h7,9,11-13H,6,8,10H2,1-5H3,(H,26,27)InChIKey
WOYIGNSNZKFRFZ-UHFFFAOYSA-NSynonyms
317325-41-0317325410
CC(C(=O)NC1=C(C2=C(S1)CC(CC2)C(C)(C)C)C(=O)OC)OC3=C(C=CC(=C3)Cl)Cl
InChI=1SC23H27Cl2NO4Sc112(30171114(24)7916(17)25)20(27)262119(22(28)295)158613(23(23)4)1018(15)3121h791113H6810H215H3(H2627)
methyl6(tertbutyl)2(2(25dichlorophenoxy)propanamido)4567tetrahydrobenzo(b)thiophene3carboxylate
methyl6tertbutyl2((2(25dichlorophenoxy)propanoyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6tertbutyl2(2(25dichlorophenoxy)propanoylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD01972806
ZINC000002321713
ZINC000002321716
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