Vitas-M small molecule compound
N-[(2E)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetamide
Catalog ID
STK649318
SMILES COCc1n[nH]/c(=N\C(=O)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 C13H12N6O3S MW 332.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N6O3S/c1-22-7-11-16-17-13(23-11)14-10(20)6-19-12(21)8-4-2-3-5-9(8)15-18-19/h2-5H,6-7H2,1H3,(H,14,17,20)InChIKey
NFXZDKNURJGFIO-UHFFFAOYSA-NSynonyms
1190277-04-31190277043
COCC1=NN=C(S1)NC(=O)CN2C(=O)C3=CC=CC=C3N=N2
COCc1n(nH)c(=NC(=O)Cn2nnc3c(c2=O)cccc3)s1
InChI=1SC13H12N6O3Sc122711161713(2311)1410(20)61912(21)842359(8)151819h25H67H21H3(H141720)
MFCD18165234
N((2E)5(methoxymethyl)134thiadiazol2(3H)ylidene)2(4oxo123benzotriazin3(4H)yl)acetamide
N(5(methoxymethyl)134thiadiazol2yl)2(4oxo123benzotriazin3yl)acetamide
ZINC000036357064
ZINC36357064
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