Vitas-M small molecule compound

ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1H-1,2,3-triazole-4-carboxylate

Catalog ID
STK672830
SMILES OCCN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)OCC

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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 C14H22N8O4 MW 366.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H22N8O4/c1-2-25-14(24)11-10(9-21-5-3-20(4-6-21)7-8-23)22(19-16-11)13-12(15)17-26-18-13/h23H,2-9H2,1H3,(H2,15,17)
InChIKey
DBWLEDGWEYHNPE-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(N=N1)C2=NON=C2N)CN3CCN(CC3)CCO
ETHYL1(4AMINO(125OXADIAZOL3YL))5((4(2HYDROXYETHYL)PIPERAZINYL)METHYL)123TRIAZOLE4CARBOXYLATE
ETHYL1(4AMINO125OXADIAZOL3YL)5((4(2HYDROXYETHYL)1PIPERAZINYL)METHYL)1H123TRIAZOLE4CARBOXYLATE
ethyl1(4amino125oxadiazol3yl)5((4(2hydroxyethyl)piperazin1yl)methyl)1H123triazole4carboxylate
ETHYL1(4AMINO125OXADIAZOL3YL)5((4(2HYDROXYETHYL)PIPERAZIN1YL)METHYL)TRIAZOLE4CARBOXYLATE
ETHYL1(4AMINO125OXADIAZOL3YL)5((4(2HYDROXYETHYL)PIPERAZINO)METHYL)1H123TRIAZOLE4CARBOXYLATE
InChI=1SC14H22N8O4c122514(24)1110(9215320(4621)7823)22(191611)1312(15)17261813h23H29H21H3(H21517)
MFCD00826374
ZINC000095481279
ZINC95481279

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Available files

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