Vitas-M small molecule compound
2-methoxyethyl 6-methyl-4-[4-(pentyloxy)phenyl]-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK817036
SMILES CCCCCOc1ccc(cc1)C1NC(=S)NC(=C1C(=O)OCCOC)C
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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 C20H28N2O4S MW 392.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N2O4S/c1-4-5-6-11-25-16-9-7-15(8-10-16)18-17(14(2)21-20(27)22-18)19(23)26-13-12-24-3/h7-10,18H,4-6,11-13H2,1-3H3,(H2,21,22,27)InChIKey
JGOSAVHWNLERIF-UHFFFAOYSA-NSynonyms
2methoxyethyl6methyl4(4(pentyloxy)phenyl)2thioxo1234tetrahydropyrimidine5carboxylate
2METHOXYETHYL6METHYL4(4PENTOXYPHENYL)2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CCCCCOC1=CC=C(C=C1)C2C(=C(NC(=S)N2)C)C(=O)OCCOC
InChI=1SC20H28N2O4Sc14561125169715(81016)1817(14(2)2120(27)2218)19(23)261312243h71018H461113H213H3(H2212227)
MFCD04482280
ZINC000006322241
ZINC000006322317
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