Vitas-M small molecule compound

N-(5-{[1-(2-methylphenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]sulfamoyl}-1,3,4-thiadiazol-2-yl)acetamide

Catalog ID
STK696067
SMILES CC(=O)Nc1nnc(s1)S(=O)(=O)NC1(C(=O)Nc2c1c(=O)[nH]c(=O)n2c1ccccc1C)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 C18H14F3N7O6S2 MW 545.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14F3N7O6S2/c1-7-5-3-4-6-9(7)28-11-10(12(30)24-15(28)32)17(13(31)23-11,18(19,20)21)27-36(33,34)16-26-25-14(35-16)22-8(2)29/h3-6,27H,1-2H3,(H,23,31)(H,22,25,29)(H,24,30,32)
InChIKey
HZWKKXCLDSAMFH-UHFFFAOYSA-N
Synonyms

CC(=O)Nc1nnc(s1)S(=O)(=O)NC1(C(=O)Nc2c1c(=O)(nH)c(=O)n2c1ccccc1C)C(F)(F)F
CC1=CC=CC=C1N2C3=C(C(=O)NC2=O)C(C(=O)N3)(C(F)(F)F)NS(=O)(=O)C4=NN=C(S4)NC(=O)C
InChI=1SC18H14F3N7O6S2c1753469(7)281110(12(30)2415(28)32)17(13(31)231118(1920)21)2736(3334)16262514(3516)228(2)29h3627H12H3(H2331)(H222529)(H243032)
MFCD06177151
N(5((1(2methylphenyl)246trioxo5(trifluoromethyl)234567hexahydro1Hpyrrolo(23d)pyrimidin5yl)sulfamoyl)134thiadiazol2yl)acetamide
N(5((1(2METHYLPHENYL)246TRIOXO5(TRIFLUOROMETHYL)7HPYRROLO(23D)PYRIMIDIN5YL)SULFAMOYL)134THIADIAZOL2YL)ACETAMIDE
ZINC000100229987
ZINC000100229990

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Available files

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