Vitas-M small molecule compound
propyl 2-{[(2,2-dibromo-1-methylcyclopropyl)carbonyl]amino}-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK450533
SMILES CCCOC(=O)c1c(NC(=O)C2(C)CC2(Br)Br)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 C23H25Br2NO3S MW 555.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25Br2NO3S/c1-3-11-29-20(27)18-16-10-9-15(14-7-5-4-6-8-14)12-17(16)30-19(18)26-21(28)22(2)13-23(22,24)25/h4-8,15H,3,9-13H2,1-2H3,(H,26,28)InChIKey
WIAKYGDWFLZLNZ-UHFFFAOYSA-NSynonyms
CCCOC(=O)C1=C(SC2=C1CCC(C2)C3=CC=CC=C3)NC(=O)C4(CC4(Br)Br)C
InChI=1SC23H25Br2NO3Sc13112920(27)181610915(147546814)1217(16)3019(18)2621(28)22(2)1323(2224)25h4815H3913H212H3(H2628)
MFCD03073534
propyl2(((22dibromo1methylcyclopropyl)carbonyl)amino)6phenyl4567tetrahydro1benzothiophene3carboxylate
propyl2((22dibromo1methylcyclopropanecarbonyl)amino)6phenyl4567tetrahydro1benzothiophene3carboxylate
ZINC000002104982
ZINC000002104987
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