Vitas-M small molecule compound
N-(4-{[1-(3-chlorophenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]sulfamoyl}phenyl)acetamide
Catalog ID
STK696060
SMILES CC(=O)Nc1ccc(cc1)S(=O)(=O)NC1(C(=O)Nc2c1c(=O)[nH]c(=O)n2c1cccc(c1)Cl)C(F)(F)F
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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 C21H15ClF3N5O6S MW 557.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15ClF3N5O6S/c1-10(31)26-12-5-7-14(8-6-12)37(35,36)29-20(21(23,24)25)15-16(27-18(20)33)30(19(34)28-17(15)32)13-4-2-3-11(22)9-13/h2-9,29H,1H3,(H,26,31)(H,27,33)(H,28,32,34)InChIKey
WFUJFHKKXZPNIP-UHFFFAOYSA-NSynonyms
CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2(C3=C(NC2=O)N(C(=O)NC3=O)C4=CC(=CC=C4)Cl)C(F)(F)F
CC(=O)Nc1ccc(cc1)S(=O)(=O)NC1(C(=O)Nc2c1c(=O)(nH)c(=O)n2c1cccc(c1)Cl)C(F)(F)F
InChI=1SC21H15ClF3N5O6Sc110(31)26125714(8612)37(3536)2920(21(2324)25)1516(2718(20)33)30(19(34)2817(15)32)1342311(22)913h2929H1H3(H2631)(H2733)(H283234)
MFCD06067869
N(4((1(3chlorophenyl)246trioxo5(trifluoromethyl)234567hexahydro1Hpyrrolo(23d)pyrimidin5yl)sulfamoyl)phenyl)acetamide
N(4((1(3chlorophenyl)246trioxo5(trifluoromethyl)7Hpyrrolo(23d)pyrimidin5yl)sulfamoyl)phenyl)acetamide
ZINC000100229963
ZINC000100229965
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