Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)methyl]-N'-[(E)-(4-methoxy-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}phenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK559416
SMILES COc1ccc(cc1CSc1nnc(s1)C)/C=N/NC(=O)c1nnn(c1CSC1=NCCS1)c1nonc1N
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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 C21H21N11O3S4 MW 603.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N11O3S4/c1-11-25-28-21(39-11)37-9-13-7-12(3-4-15(13)34-2)8-24-27-19(33)16-14(10-38-20-23-5-6-36-20)32(31-26-16)18-17(22)29-35-30-18/h3-4,7-8H,5-6,9-10H2,1-2H3,(H2,22,29)(H,27,33)/b24-8+InChIKey
FPEBOWFSDGQHSP-KTZMUZOWSA-NSynonyms
(E)1(4amino125oxadiazol3yl)5(((45dihydrothiazol2yl)thio)methyl)N(4methoxy3(((5methyl134thiadiazol2yl)thio)methyl)benzylidene)1H123triazole4carbohydrazide1(4amino125oxadiazol3yl)5((45dihydro13thiazol2ylsulfanyl)methyl)N((E)(4methoxy3(((5methyl134thiadiazol2yl)sulfanyl)methyl)phenyl)methylidene)1H123triazole4carbohy
1(4amino125oxadiazol3yl)5(45dihydro13thiazol2ylsulfanylmethyl)N((E)(4methoxy3((5methyl134thiadiazol2yl)sulfanylmethyl)phenyl)methylideneamino)triazole4carboxamide
CC1=NN=C(S1)SCC2=C(C=CC(=C2)C=NNC(=O)C3=C(N(N=N3)C4=NON=C4N)CSC5=NCCS5)OC
COc1ccc(cc1CSc1nnc(s1)C)C=NNC(=O)c1nnn(c1CSC1=NCCS1)c1nonc1N
DRAZIDE
Registry IDs
MFCD03340089ZINC000097966756
ZINC102486912
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