Vitas-M small molecule compound

N-(2,6-dimethylphenyl)-2-[({4-oxo-3-[3-(trifluoromethyl)phenyl]-3,4-dihydroquinazolin-2-yl}methyl)sulfanyl]acetamide

Catalog ID
STK733012
SMILES O=C(Nc1c(C)cccc1C)CSCc1nc2ccccc2c(=O)n1c1cccc(c1)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 C26H22F3N3O2S MW 497.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22F3N3O2S/c1-16-7-5-8-17(2)24(16)31-23(33)15-35-14-22-30-21-12-4-3-11-20(21)25(34)32(22)19-10-6-9-18(13-19)26(27,28)29/h3-13H,14-15H2,1-2H3,(H,31,33)
InChIKey
IDBCNYZSKAIEKQ-UHFFFAOYSA-N
Synonyms
296789-49-6
296789496
CC1=C(C(=CC=C1)C)NC(=O)CSCC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC(=C4)C(F)(F)F
InChI=1SC26H22F3N3O2Sc11675817(2)24(16)3123(33)15351422302112431120(21)25(34)32(22)19106918(1319)26(2728)29h313H1415H212H3(H3133)
MFCD01203163
N(26dimethylphenyl)2(((4oxo3(3(trifluoromethyl)phenyl)34dihydroquinazolin2yl)methyl)sulfanyl)acetamide
N(26dimethylphenyl)2(((4oxo3(3(trifluoromethyl)phenyl)34dihydroquinazolin2yl)methyl)thio)acetamide
N(26DIMETHYLPHENYL)2((4OXO3(3(TRIFLUOROMETHYL)PHENYL)QUINAZOLIN2YL)METHYLSULFANYL)ACETAMIDE
ZINC000002338836
ZINC02338836
ZINC2338836

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.