Vitas-M small molecule compound

prop-2-en-1-yl 4-(4-fluorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK704301
SMILES C=CCOC(=O)C1=C(C)NC(=S)NC1c1ccc(cc1)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 C15H15FN2O2S MW 306.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15FN2O2S/c1-3-8-20-14(19)12-9(2)17-15(21)18-13(12)10-4-6-11(16)7-5-10/h3-7,13H,1,8H2,2H3,(H2,17,18,21)
InChIKey
RXTPMSMNBCYLSH-UHFFFAOYSA-N
Synonyms

CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)F)C(=O)OCC=C
InChI=1SC15H15FN2O2Sc1382014(19)129(2)1715(21)1813(12)104611(16)7510h3713H18H22H3(H2171821)
MFCD04446479
prop2en1yl4(4fluorophenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
PROP2ENYL4(4FLUOROPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ZINC000006307957
ZINC000006308038

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Available files

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