Vitas-M small molecule compound

1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-fluorophenyl)ethylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STL311170
SMILES Fc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1CSc1nncn1C)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 C17H16FN11O2S MW 457.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16FN11O2S/c1-9(10-3-5-11(18)6-4-10)21-23-16(30)13-12(7-32-17-24-20-8-28(17)2)29(27-22-13)15-14(19)25-31-26-15/h3-6,8H,7H2,1-2H3,(H2,19,25)(H,23,30)/b21-9+
InChIKey
HMAIUXGCZXSRGU-ZVBGSRNCSA-N
Synonyms
848990-16-9
(E)1(4amino125oxadiazol3yl)N(1(4fluorophenyl)ethylidene)5(((4methyl4H124triazol3yl)thio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((1E)1(4fluorophenyl)ethylidene)5(((4methyl4H124triazol3yl)sulfanyl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)1(4fluorophenyl)ethylideneamino)5((4methyl124triazol3yl)sulfanylmethyl)triazole4carboxamide
848990169
CC(=NNC(=O)C1=C(N(N=N1)C2=NON=C2N)CSC3=NN=CN3C)C4=CC=C(C=C4)F
Fc1ccc(cc1)C(=NNC(=O)c1nnn(c1CSc1nncn1C)c1nonc1N)C
InChI=1SC17H16FN11O2Sc19(103511(18)6410)212316(30)1312(732172420828(17)2)29(272213)1514(19)25312615h368H7H212H3(H21925)(H2330)b219+
MFCD05678916
ZINC000013787608
ZINC33655844

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Available files

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