Vitas-M small molecule compound
ethyl 5-(chloromethyl)-1-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1H-1,2,3-triazole-4-carboxylate
Catalog ID
STK679820
SMILES CCOC(=O)c1nnn(c1CCl)c1nonc1n1cccc1
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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 C12H11ClN6O3 MW 322.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11ClN6O3/c1-2-21-12(20)9-8(7-13)19(17-14-9)11-10(15-22-16-11)18-5-3-4-6-18/h3-6H,2,7H2,1H3InChIKey
WDPUQPVIFCAYLD-UHFFFAOYSA-NSynonyms
681851-71-81H(123)TRIAZOLE4CARBOXYLICACID5CHLOROMETHYL1(4PYRROL1YLFURAZAN3YL)ETHYLESTER
681851718
CCOC(=O)C1=C(N(N=N1)C2=NON=C2N3C=CC=C3)CCl
ethyl5(chloromethyl)1(4(1Hpyrrol1yl)125oxadiazol3yl)1H123triazole4carboxylate
ETHYL5(CHLOROMETHYL)1(4(PYRROL1YL)125OXADIAZOL3YL)123TRIAZOLE4CARBOXYLATE
ETHYL5(CHLOROMETHYL)1(4PYRROL1YL125OXADIAZOL3YL)TRIAZOLE4CARBOXYLATE
InChI=1SC12H11ClN6O3c122112(20)98(713)19(17149)1110(15221611)18534618h36H27H21H3
MFCD03766116
ZINC000000099236
ZINC00099236
ZINC99236
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