Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(methylsulfanyl)phenyl]methylidene}-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL053972
SMILES CSc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccc(cc1)[N+](=O)[O-])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 C19H15N9O4S MW 465.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N9O4S/c1-33-14-8-2-11(3-9-14)10-21-23-19(29)15-16(12-4-6-13(7-5-12)28(30)31)27(26-22-15)18-17(20)24-32-25-18/h2-10H,1H3,(H2,20,24)(H,23,29)/b21-10+InChIKey
IHEXKFBTXRPLFY-UFFVCSGVSA-NSynonyms
714290-03-6(E)1(4amino125oxadiazol3yl)N(4(methylthio)benzylidene)5(4nitrophenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(4(methylsulfanyl)phenyl)methylidene)5(4nitrophenyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)(4METHYLSULFANYLPHENYL)METHYLIDENEAMINO)5(4NITROPHENYL)TRIAZOLE4CARBOXAMIDE
714290036
CSC1=CC=C(C=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC=C(C=C4)(N+)(=O)(O)
CSc1ccc(cc1)C=NNC(=O)c1nnn(c1c1ccc(cc1)(N+)(=O)(O))c1nonc1N
InChI=1SC19H15N9O4Sc133148211(3914)10212319(29)1516(124613(7512)28(30)31)27(262215)1817(20)24322518h210H1H3(H22024)(H2329)b2110+
MFCD03171297
ZINC000001876130
ZINC33345704
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