Vitas-M small molecule compound
ethyl ({(4E)-1-(3-methoxypropyl)-4-[(1-methyl-1H-pyrazol-4-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetate
Catalog ID
STL398353
SMILES COCCCN1C(=N/C(=C/c2cnn(c2)C)/C1=O)SCC(=O)OCC
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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 C16H22N4O4S MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N4O4S/c1-4-24-14(21)11-25-16-18-13(8-12-9-17-19(2)10-12)15(22)20(16)6-5-7-23-3/h8-10H,4-7,11H2,1-3H3/b13-8+InChIKey
PVWCDAOGPSINFL-MDWZMJQESA-NSynonyms
1005555-92-91005555929
CCOC(=O)CSC1=NC(=CC2=CN(N=C2)C)C(=O)N1CCCOC
COCCCN1C(=NC(=Cc2cnn(c2)C)C1=O)SCC(=O)OCC
ETHYL(((4E)1(3METHOXYPROPYL)4((1METHYL1HPYRAZOL4YL)METHYLIDENE)5OXO45DIHYDRO1HIMIDAZOL2YL)SULFANYL)ACETATE
ethyl2((4E)1(3methoxypropyl)4((1methylpyrazol4yl)methylidene)5oxoimidazol2yl)sulfanylacetate
InChI=1SC16H22N4O4Sc142414(21)1125161813(81291719(2)1012)15(22)20(16)657233h810H4711H213H3b138+
MFCD04050302
ZINC000002786117
ZINC02786117
ZINC2786117
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