Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-{(E)-[4-(diethylamino)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL002873
SMILES CCN(c1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)CC
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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 C23H23N9O4 MW 489.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N9O4/c1-3-31(4-2)16-8-5-14(6-9-16)12-25-27-23(33)19-20(15-7-10-17-18(11-15)35-13-34-17)32(30-26-19)22-21(24)28-36-29-22/h5-12H,3-4,13H2,1-2H3,(H2,24,28)(H,27,33)/b25-12+InChIKey
HAJNBRLFVHTZEB-BRJLIKDPSA-NSynonyms
848992-86-9(E)1(4amino125oxadiazol3yl)5(benzo(d)(13)dioxol5yl)N(4(diethylamino)benzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((E)(4(diethylamino)phenyl)methylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5(13BENZODIOXOL5YL)N((E)(4(DIETHYLAMINO)PHENYL)METHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
848992869
CCN(c1ccc(cc1)C=NNC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)CC
CCN(CC)C1=CC=C(C=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC5=C(C=C4)OCO5
InChI=1SC23H23N9O4c1331(42)168514(6916)12252723(33)1920(157101718(1115)35133417)32(302619)2221(24)28362922h512H3413H212H3(H22428)(H2733)b2512+
MFCD05679137
ZINC000002447049
ZINC33372676
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