Vitas-M small molecule compound
5-{3-methoxy-4-[2-oxo-2-(pyrrolidin-1-yl)ethoxy]benzylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL380188
SMILES COc1cc(ccc1OCC(=O)N1CCCC1)C=C1C(=O)NC(=S)NC1=O
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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 C18H19N3O5S MW 389.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O5S/c1-25-14-9-11(8-12-16(23)19-18(27)20-17(12)24)4-5-13(14)26-10-15(22)21-6-2-3-7-21/h4-5,8-9H,2-3,6-7,10H2,1H3,(H2,19,20,23,24,27)InChIKey
AWXYNNZTHHZIMC-UHFFFAOYSA-NSynonyms
5((3METHOXY4(2OXO2PYRROLIDIN1YLETHOXY)PHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5(3METHOXY4(2OXO2(1PYRROLIDINYL)ETHOXY)BENZYLIDENE)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
5(3methoxy4(2oxo2(pyrrolidin1yl)ethoxy)benzylidene)2thioxodihydropyrimidine46(1H5H)dione
COC1=C(C=CC(=C1)C=C2C(=O)NC(=S)NC2=O)OCC(=O)N3CCCC3
InChI=1SC18H19N3O5Sc12514911(81216(23)1918(27)2017(12)24)4513(14)261015(22)21623721h4589H236710H21H3(H21920232427)
MFCD04151763
ZINC000004649352
ZINC04649352
ZINC4649352
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