Vitas-M small molecule compound

5-[{[2-(3-chlorophenyl)-2-oxoethyl]sulfanyl}(methylamino)methylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK207900
SMILES CNC(=C1C(=O)N(C)C(=O)N(C1=O)C)SCC(=O)c1cccc(c1)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 C16H16ClN3O4S MW 381.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN3O4S/c1-18-13(12-14(22)19(2)16(24)20(3)15(12)23)25-8-11(21)9-5-4-6-10(17)7-9/h4-7,18H,8H2,1-3H3
InChIKey
JIQBAEYTLVPJAA-UHFFFAOYSA-N
Synonyms

5(((2(3chlorophenyl)2oxoethyl)sulfanyl)(methylamino)methylidene)13dimethylpyrimidine246(1H3H5H)trione
5(((2(3chlorophenyl)2oxoethyl)thio)(methylamino)methylene)13dimethylpyrimidine246(1H3H5H)trione
5((2(3CHLOROPHENYL)2OXOETHYL)SULFANYL(METHYLAMINO)METHYLIDENE)13DIMETHYL13DIAZINANE246TRIONE
5((2(3CHLOROPHENYL)2OXOETHYLSULFANYL)METHYLAMINOMETHYLENE)13DIMETHYLPYRIMIDINE246TRIONE
5((2(3CHLOROPHENYL)2OXOETHYLTHIO)(METHYLAMINO)METHYLENE)13DIMETHYL13DIHYDROPYRIMIDINE246TRIONE
CNC(=C1C(=O)N(C(=O)N(C1=O)C)C)SCC(=O)C2=CC(=CC=C2)Cl
InChI=1SC16H16ClN3O4Sc11813(1214(22)19(2)16(24)20(3)15(12)23)25811(21)954610(17)79h4718H8H213H3
MFCD06603378
ZINC000005789220
ZINC05789220
ZINC5789220

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Available files

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