Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-cyanophenyl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL347632
SMILES N#Cc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1CSc1ccccc1)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 C21H17N9O2S MW 459.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N9O2S/c1-13(15-9-7-14(11-22)8-10-15)24-26-21(31)18-17(12-33-16-5-3-2-4-6-16)30(29-25-18)20-19(23)27-32-28-20/h2-10H,12H2,1H3,(H2,23,27)(H,26,31)/b24-13+InChIKey
GKIWTTRIECJODM-ZMOGYAJESA-NSynonyms
861122-85-2(E)1(4amino125oxadiazol3yl)N(1(4cyanophenyl)ethylidene)5((phenylthio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((1E)1(4cyanophenyl)ethylidene)5((phenylsulfanyl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)1(4cyanophenyl)ethylideneamino)5(phenylsulfanylmethyl)triazole4carboxamide
861122852
CC(=NNC(=O)C1=C(N(N=N1)C2=NON=C2N)CSC3=CC=CC=C3)C4=CC=C(C=C4)C#N
InChI=1SC21H17N9O2Sc113(159714(1122)81015)242621(31)1817(1233165324616)30(292518)2019(23)27322820h210H12H21H3(H22327)(H2631)b2413+
MFCD05683483
N#Cc1ccc(cc1)C(=NNC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)C
ZINC000009307802
ZINC97494808
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