Vitas-M small molecule compound
2-methylpropyl 4-(3,4-diethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK816947
SMILES CCOc1cc(ccc1OCC)C1NC(=S)NC(=C1C(=O)OCC(C)C)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/c1-6-24-15-9-8-14(10-16(15)25-7-2)18-17(13(5)21-20(27)22-18)19(23)26-11-12(3)4/h8-10,12,18H,6-7,11H2,1-5H3,(H2,21,22,27)InChIKey
JLYATKAFODPYRA-UHFFFAOYSA-NSynonyms
2METHYLPROPYL4(34DIETHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
2methylpropyl4(34diethoxyphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
CCOC1=C(C=C(C=C1)C2C(=C(NC(=S)N2)C)C(=O)OCC(C)C)OCC
InChI=1SC20H28N2O4Sc1624159814(1016(15)2572)1817(13(5)2120(27)2218)19(23)261112(3)4h8101218H6711H215H3(H2212227)
MFCD04446182
ZINC000006155853
ZINC000006155858
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