Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-methoxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL003767
SMILES COc1cccc(c1)/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N
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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 C20H18N8O3S MW 450.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N8O3S/c1-30-14-7-5-6-13(10-14)11-22-24-20(29)17-16(12-32-15-8-3-2-4-9-15)28(27-23-17)19-18(21)25-31-26-19/h2-11H,12H2,1H3,(H2,21,25)(H,24,29)/b22-11+InChIKey
DVNATCLGWOAMSI-SSDVNMTOSA-NSynonyms
840499-08-3(E)1(4amino125oxadiazol3yl)N(3methoxybenzylidene)5((phenylthio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(3methoxyphenyl)methylidene)5((phenylsulfanyl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(3methoxyphenyl)methylideneamino)5(phenylsulfanylmethyl)triazole4carboxamide
840499083
COC1=CC=CC(=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)CSC4=CC=CC=C4
COc1cccc(c1)C=NNC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N
InChI=1SC20H18N8O3Sc1301475613(1014)11222420(29)1716(1232158324915)28(272317)1918(21)25312619h211H12H21H3(H22125)(H2429)b2211+
MFCD04008763
ZINC000013751865
ZINC33600747
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