Vitas-M small molecule compound

methyl 4-(4-fluorophenyl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK323368
SMILES COC(=O)C1=C(NC(=S)NC1c1ccc(cc1)F)c1ccccc1

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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 C18H15FN2O2S MW 342.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15FN2O2S/c1-23-17(22)14-15(11-5-3-2-4-6-11)20-18(24)21-16(14)12-7-9-13(19)10-8-12/h2-10,16H,1H3,(H2,20,21,24)
InChIKey
GKSIPEUZXCXJEO-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)F)C3=CC=CC=C3
InChI=1SC18H15FN2O2Sc12317(22)1415(115324611)2018(24)2116(14)127913(19)10812h21016H1H3(H2202124)
METHYL4(4FLUOROPHENYL)6PHENYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
methyl4(4fluorophenyl)6phenyl2thioxo1234tetrahydropyrimidine5carboxylate
MFCD06003227
ZINC000000529091
ZINC000000529092

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Available files

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