Vitas-M small molecule compound
propan-2-yl 5-carbamoyl-2-({[4-(2-fluorophenyl)piperazin-1-yl]acetyl}amino)-4-methylthiophene-3-carboxylate
Catalog ID
STK458816
SMILES O=C(Nc1sc(c(c1C(=O)OC(C)C)C)C(=O)N)CN1CCN(CC1)c1ccccc1F
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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 C22H27FN4O4S MW 462.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27FN4O4S/c1-13(2)31-22(30)18-14(3)19(20(24)29)32-21(18)25-17(28)12-26-8-10-27(11-9-26)16-7-5-4-6-15(16)23/h4-7,13H,8-12H2,1-3H3,(H2,24,29)(H,25,28)InChIKey
KEAPYDXBSVREIH-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)CN2CCN(CC2)C3=CC=CC=C3F)C(=O)N
InChI=1SC22H27FN4O4Sc113(2)3122(30)1814(3)19(20(24)29)3221(18)2517(28)122681027(11926)16754615(16)23h4713H812H213H3(H22429)(H2528)
MFCD05070771
propan2yl5carbamoyl2(((4(2fluorophenyl)piperazin1yl)acetyl)amino)4methylthiophene3carboxylate
propan2yl5carbamoyl2((2(4(2fluorophenyl)piperazin1yl)acetyl)amino)4methylthiophene3carboxylate
ZINC000020295034
ZINC20295034
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