Vitas-M small molecule compound
ethyl 4-(5-iodo-2-methoxyphenyl)-6-propyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL181545
SMILES CCOC(=O)C1=C(CCC)NC(=S)NC1c1cc(I)ccc1OC
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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 C17H21IN2O3S MW 460.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21IN2O3S/c1-4-6-12-14(16(21)23-5-2)15(20-17(24)19-12)11-9-10(18)7-8-13(11)22-3/h7-9,15H,4-6H2,1-3H3,(H2,19,20,24)InChIKey
XFSZUJDLDDTIDG-UHFFFAOYSA-NSynonyms
CCCC1=C(C(NC(=S)N1)C2=C(C=CC(=C2)I)OC)C(=O)OCC
ETHYL4(5IODO2METHOXYPHENYL)6PROPYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ethyl4(5iodo2methoxyphenyl)6propyl2thioxo1234tetrahydropyrimidine5carboxylate
InChI=1SC17H21IN2O3Sc1461214(16(21)2352)15(2017(24)1912)11910(18)7813(11)223h7915H46H213H3(H2192024)
MFCD05992465
ZINC000016361524
ZINC000016361526
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