Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(azepan-1-ylmethyl)-1H-1,2,3-triazole-4-carboxylic acid
Catalog ID
STK679374
SMILES OC(=O)c1nnn(c1CN1CCCCCC1)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 C12H17N7O3 MW 307.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17N7O3/c13-10-11(16-22-15-10)19-8(9(12(20)21)14-17-19)7-18-5-3-1-2-4-6-18/h1-7H2,(H2,13,15)(H,20,21)InChIKey
IWUZTHHACDFAMC-UHFFFAOYSA-NSynonyms
1(4AMINO125OXADIAZOL3YL)5(AZEPAN1IUM1YLMETHYL)TRIAZOLE4CARBOXYLATE
1(4amino125oxadiazol3yl)5(azepan1ylmethyl)1H123triazole4carboxylicacid
1(4AMINO125OXADIAZOL3YL)5(AZEPAN1YLMETHYL)TRIAZOLE4CARBOXYLICACID
C1CCCN(CC1)CC2=C(N=NN2C3=NON=C3N)C(=O)O
InChI=1SC12H17N7O3c131011(16221510)198(9(12(20)21)141719)71853124618h17H2(H21315)(H2021)
MFCD02130402
ZINC000000093977
ZINC00093977
ZINC93977
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