Vitas-M small molecule compound
N-[(2E)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]benzamide
Catalog ID
STL249725
SMILES COCc1n[nH]/c(=N\C(=O)c2ccc(cc2)Cn2nnc3c(c2=O)cccc3)/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 C19H16N6O3S MW 408.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N6O3S/c1-28-11-16-22-23-19(29-16)20-17(26)13-8-6-12(7-9-13)10-25-18(27)14-4-2-3-5-15(14)21-24-25/h2-9H,10-11H2,1H3,(H,20,23,26)InChIKey
YYHISVNIQGQWOK-UHFFFAOYSA-NSynonyms
1374521-58-01374521580
COCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4N=N3
COCc1n(nH)c(=NC(=O)c2ccc(cc2)Cn2nnc3c(c2=O)cccc3)s1
InChI=1SC19H16N6O3Sc1281116222319(2916)2017(26)138612(7913)102518(27)14423515(14)212425h29H1011H21H3(H202326)
MFCD24861621
N((2E)5(methoxymethyl)134thiadiazol2(3H)ylidene)4((4oxo123benzotriazin3(4H)yl)methyl)benzamide
N(5(methoxymethyl)134thiadiazol2yl)4((4oxo123benzotriazin3yl)methyl)benzamide
ZINC000072405556
ZINC72405556
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