Vitas-M small molecule compound

2-(ethylsulfanyl)ethyl 4-(4-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK402646
SMILES CCSCCOC(=O)C1=C(C)NC(=O)NC1c1ccc(cc1)Cl

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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 C16H19ClN2O3S MW 354.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19ClN2O3S/c1-3-23-9-8-22-15(20)13-10(2)18-16(21)19-14(13)11-4-6-12(17)7-5-11/h4-7,14H,3,8-9H2,1-2H3,(H2,18,19,21)
InChIKey
QSISUYBGIPQTPF-UHFFFAOYSA-N
Synonyms
5613-39-8
2(ethylsulfanyl)ethyl4(4chlorophenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
2ETHYLSULFANYLETHYL4(4CHLOROPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
5613398
CCSCCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)Cl)C
InChI=1SC16H19ClN2O3Sc1323982215(20)1310(2)1816(21)1914(13)114612(17)7511h4714H389H212H3(H2181921)
MFCD01193028
ZINC000004189417
ZINC000004189418

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Available files

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