Vitas-M small molecule compound
ethyl 2-{[(4-bromophenyl)carbonyl]amino}-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK408949
SMILES CCOC(=O)c1c(NC(=O)c2ccc(cc2)Br)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 C22H26BrNO3S MW 464.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26BrNO3S/c1-5-27-21(26)18-16-11-8-14(22(2,3)4)12-17(16)28-20(18)24-19(25)13-6-9-15(23)10-7-13/h6-7,9-10,14H,5,8,11-12H2,1-4H3,(H,24,25)InChIKey
DGRIDBWNPJZUSN-UHFFFAOYSA-NSynonyms
354547-22-1354547221
CCOC(=O)C1=C(SC2=C1CCC(C2)C(C)(C)C)NC(=O)C3=CC=C(C=C3)Br
ethyl2(((4bromophenyl)carbonyl)amino)6tertbutyl4567tetrahydro1benzothiophene3carboxylate
ethyl2((4bromobenzoyl)amino)6tertbutyl4567tetrahydro1benzothiophene3carboxylate
InChI=1SC22H26BrNO3Sc152721(26)181611814(22(23)4)1217(16)2820(18)2419(25)136915(23)10713h6791014H581112H214H3(H2425)
MFCD01338442
ZINC000001918422
ZINC000001918423
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