Vitas-M small molecule compound

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

Catalog ID
STK402595
SMILES CCSCCOC(=O)C1=C(C)NC(=O)NC1c1cccc(c1)Br

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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 C16H19BrN2O3S MW 399.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19BrN2O3S/c1-3-23-8-7-22-15(20)13-10(2)18-16(21)19-14(13)11-5-4-6-12(17)9-11/h4-6,9,14H,3,7-8H2,1-2H3,(H2,18,19,21)
InChIKey
BACWJVRCQGCPQH-UHFFFAOYSA-N
Synonyms
5608-36-6
2(ethylsulfanyl)ethyl4(3bromophenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
2ETHYLSULFANYLETHYL4(3BROMOPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
2ETHYLTHIOETHYL6(3BROMOPHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
5608366
CCSCCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC=C2)Br)C
InChI=1SC16H19BrN2O3Sc1323872215(20)1310(2)1816(21)1914(13)1154612(17)911h46914H378H212H3(H2181921)
MFCD01193451
ZINC000004854805
ZINC000004854806

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Available files

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