Vitas-M small molecule compound
2-(1,3-benzodioxol-5-yl)-N-[(2E)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-1-methyl-5-oxopyrrolidine-3-carboxamide
Catalog ID
STL316542
SMILES COCc1n[nH]/c(=N\C(=O)C2CC(=O)N(C2c2ccc3c(c2)OCO3)C)/s1
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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 C17H18N4O5S MW 390.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O5S/c1-21-14(22)6-10(16(23)18-17-20-19-13(27-17)7-24-2)15(21)9-3-4-11-12(5-9)26-8-25-11/h3-5,10,15H,6-8H2,1-2H3,(H,18,20,23)InChIKey
YWGHILROSIHPIN-UHFFFAOYSA-NSynonyms
1435999-67-91435999679
2(13benzodioxol5yl)N((2E)5(methoxymethyl)134thiadiazol2(3H)ylidene)1methyl5oxopyrrolidine3carboxamide
2(13benzodioxol5yl)N(5(methoxymethyl)134thiadiazol2yl)1methyl5oxopyrrolidine3carboxamide
CN1C(C(CC1=O)C(=O)NC2=NN=C(S2)COC)C3=CC4=C(C=C3)OCO4
COCc1n(nH)c(=NC(=O)C2CC(=O)N(C2c2ccc3c(c2)OCO3)C)s1
InChI=1SC17H18N4O5Sc12114(22)610(16(23)1817201913(2717)7242)15(21)9341112(59)2682511h351015H68H212H3(H182023)
MFCD28027870
ZINC000095477848
ZINC000095477851
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