Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2E)-butan-2-ylidene]-5-[(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK556429
SMILES CC/C(=N/NC(=O)c1nnn(c1CSC1=NCCS1)c1nonc1N)/C
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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 C13H17N9O2S2 MW 395.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N9O2S2/c1-3-7(2)16-18-12(23)9-8(6-26-13-15-4-5-25-13)22(21-17-9)11-10(14)19-24-20-11/h3-6H2,1-2H3,(H2,14,19)(H,18,23)/b16-7+InChIKey
HQIPQUTZQOWSBS-FRKPEAEDSA-NSynonyms
573698-34-7(E)1(4amino125oxadiazol3yl)N(butan2ylidene)5(((45dihydrothiazol2yl)thio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((2E)butan2ylidene)5((45dihydro13thiazol2ylsulfanyl)methyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)BUTAN2YLIDENEAMINO)5(45DIHYDRO13THIAZOL2YLSULFANYLMETHYL)TRIAZOLE4CARBOXAMIDE
573698347
CCC(=NNC(=O)C1=C(N(N=N1)C2=NON=C2N)CSC3=NCCS3)C
CCC(=NNC(=O)c1nnn(c1CSC1=NCCS1)c1nonc1N)C
InChI=1SC13H17N9O2S2c137(2)161812(23)98(6261315452513)22(21179)1110(14)19242011h36H212H3(H21419)(H1823)b167+
MFCD03335060
ZINC000008771733
ZINC33747391
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