Vitas-M small molecule compound
propan-2-yl 4-(3,4-diethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK863091
SMILES CCOc1cc(ccc1OCC)C1NC(=S)NC(=C1C(=O)OC(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 C19H26N2O4S MW 378.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N2O4S/c1-6-23-14-9-8-13(10-15(14)24-7-2)17-16(18(22)25-11(3)4)12(5)20-19(26)21-17/h8-11,17H,6-7H2,1-5H3,(H2,20,21,26)InChIKey
NFVPYYDFNUZYKJ-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C2C(=C(NC(=S)N2)C)C(=O)OC(C)C)OCC
InChI=1SC19H26N2O4Sc1623149813(1015(14)2472)1716(18(22)2511(3)4)12(5)2019(26)2117h81117H67H215H3(H2202126)
MFCD04446183
PROPAN2YL4(34DIETHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
propan2yl4(34diethoxyphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
ZINC000005573477
ZINC000005573481
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