Vitas-M small molecule compound
ethyl 2-[({[4-(4-bromophenyl)pyrimidin-2-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK310676
SMILES CCOC(=O)c1c(NC(=O)CSc2nccc(n2)c2ccc(cc2)Br)sc2c1CCCC2
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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 C23H22BrN3O3S2 MW 532.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3O3S2/c1-2-30-22(29)20-16-5-3-4-6-18(16)32-21(20)27-19(28)13-31-23-25-12-11-17(26-23)14-7-9-15(24)10-8-14/h7-12H,2-6,13H2,1H3,(H,27,28)InChIKey
QIIQXHXSVPWTNT-UHFFFAOYSA-NSynonyms
832130-02-6832130026
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSC3=NC=CC(=N3)C4=CC=C(C=C4)Br
ethyl2((((4(4bromophenyl)pyrimidin2yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2(4(4bromophenyl)pyrimidin2yl)sulfanylacetyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC23H22BrN3O3S2c123022(29)2016534618(16)3221(20)2719(28)13312325121117(2623)147915(24)10814h712H2613H21H3(H2728)
MFCD04054267
ZINC000002805569
ZINC2805569
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