Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(1,3-benzodioxol-5-yl)ethylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL348140
SMILES O=C(c1nnn(c1CSc1nncn1C)c1nonc1N)N/N=C(/c1ccc2c(c1)OCO2)\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 C18H17N11O4S MW 483.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N11O4S/c1-9(10-3-4-12-13(5-10)32-8-31-12)21-23-17(30)14-11(6-34-18-24-20-7-28(18)2)29(27-22-14)16-15(19)25-33-26-16/h3-5,7H,6,8H2,1-2H3,(H2,19,25)(H,23,30)/b21-9+InChIKey
BUJCVVIKBNZJAG-ZVBGSRNCSA-NSynonyms
861645-14-9(E)1(4amino125oxadiazol3yl)N(1(benzo(d)(13)dioxol5yl)ethylidene)5(((4methyl4H124triazol3yl)thio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((1E)1(13benzodioxol5yl)ethylidene)5(((4methyl4H124triazol3yl)sulfanyl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)1(13benzodioxol5yl)ethylideneamino)5((4methyl124triazol3yl)sulfanylmethyl)triazole4carboxamide
861645149
CC(=NNC(=O)C1=C(N(N=N1)C2=NON=C2N)CSC3=NN=CN3C)C4=CC5=C(C=C4)OCO5
InChI=1SC18H17N11O4Sc19(10341213(510)3283112)212317(30)1411(634182420728(18)2)29(272214)1615(19)25332616h357H68H212H3(H21925)(H2330)b219+
MFCD05686157
O=C(c1nnn(c1CSc1nncn1C)c1nonc1N)NN=C(c1ccc2c(c1)OCO2)C
ZINC000009496687
ZINC34366987
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