Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2E)-4-(4-methoxyphenyl)butan-2-ylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL347035
SMILES COc1ccc(cc1)CC/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 C20H23N11O3S MW 497.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N11O3S/c1-12(4-5-13-6-8-14(33-3)9-7-13)23-25-19(32)16-15(10-35-20-26-22-11-30(20)2)31(29-24-16)18-17(21)27-34-28-18/h6-9,11H,4-5,10H2,1-3H3,(H2,21,27)(H,25,32)/b23-12+InChIKey
HNDPLOVCGFTKRY-FSJBWODESA-NSynonyms
849007-00-7(E)1(4amino125oxadiazol3yl)N(4(4methoxyphenyl)butan2ylidene)5(((4methyl4H124triazol3yl)thio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((2E)4(4methoxyphenyl)butan2ylidene)5(((4methyl4H124triazol3yl)sulfanyl)methyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)4(4METHOXYPHENYL)BUTAN2YLIDENEAMINO)5((4METHYL124TRIAZOL3YL)SULFANYLMETHYL)TRIAZOLE4CARBOXAMIDE
849007007
CC(=NNC(=O)C1=C(N(N=N1)C2=NON=C2N)CSC3=NN=CN3C)CCC4=CC=C(C=C4)OC
COc1ccc(cc1)CCC(=NNC(=O)c1nnn(c1CSc1nncn1C)c1nonc1N)C
InChI=1SC20H23N11O3Sc112(45136814(333)9713)232519(32)1615(10352026221130(20)2)31(292416)1817(21)27342818h6911H4510H213H3(H22127)(H2532)b2312+
MFCD05680368
ZINC000009235669
ZINC35252908
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