Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-1,3-benzodioxol-5-ylmethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL003631
SMILES O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)N/N=C/c1ccc2c(c1)OCO2
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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 C20H16N8O4S MW 464.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N8O4S/c21-18-19(26-32-25-18)28-14(10-33-13-4-2-1-3-5-13)17(23-27-28)20(29)24-22-9-12-6-7-15-16(8-12)31-11-30-15/h1-9H,10-11H2,(H2,21,25)(H,24,29)/b22-9+InChIKey
GXRYGLWERLKKEY-LSFURLLWSA-NSynonyms
573708-08-4(E)1(4amino125oxadiazol3yl)N(benzo(d)(13)dioxol5ylmethylene)5((phenylthio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)13benzodioxol5ylmethylidene)5((phenylsulfanyl)methyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)13BENZODIOXOL5YLMETHYLIDENEAMINO)5(PHENYLSULFANYLMETHYL)TRIAZOLE4CARBOXAMIDE
573708084
C1OC2=C(O1)C=C(C=C2)C=NNC(=O)C3=C(N(N=N3)C4=NON=C4N)CSC5=CC=CC=C5
InChI=1SC20H16N8O4Sc211819(26322518)2814(1033134213513)17(232728)20(29)2422912671516(812)31113015h19H1011H2(H22125)(H2429)b229+
MFCD04018245
O=C(c1nnn(c1CSc1ccccc1)c1nonc1N)NN=Cc1ccc2c(c1)OCO2
ZINC000002445673
ZINC33372593
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