Vitas-M small molecule compound
3-(ethylsulfanyl)-5-methyl-N-[(E)-{5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}methylidene]-4H-1,2,4-triazol-4-amine
Catalog ID
STL398061
SMILES CCSc1nnc(n1/N=C/c1ccc(o1)Cn1ncc(c1)[N+](=O)[O-])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 C14H15N7O3S MW 361.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N7O3S/c1-3-25-14-18-17-10(2)20(14)16-7-12-4-5-13(24-12)9-19-8-11(6-15-19)21(22)23/h4-8H,3,9H2,1-2H3/b16-7+InChIKey
HGQXPLVONZXVGE-FRKPEAEDSA-NSynonyms
1005578-90-4(E)N(3ethylsulfanyl5methyl124triazol4yl)1(5((4nitropyrazol1yl)methyl)furan2yl)methanimine
1005578904
3(ETHYLSULFANYL)5METHYLN((E)(5((4NITRO1HPYRAZOL1YL)METHYL)FURAN2YL)METHYLIDENE)4H124TRIAZOL4AMINE
CCSC1=NN=C(N1N=CC2=CC=C(O2)CN3C=C(C=N3)(N+)(=O)(O))C
CCSc1nnc(n1N=Cc1ccc(o1)Cn1ncc(c1)(N+)(=O)(O))C
InChI=1SC14H15N7O3Sc132514181710(2)20(14)167124513(2412)919811(61519)21(22)23h48H39H212H3b167+
MFCD08553322
ZINC000017074384
ZINC101584242
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