ETHYL 4-(([1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-4-(ETHOXYCARBONYL)-1H-1,2,3-TRIAZOL-5-YL]METHYL)AMINO)BENZOATE

CAS号
CCD编号
CCD00206474
分子式
C17 H19 N7 O5
分子量
401.381

基本信息

产品名称: ETHYL 4-(([1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-4-(ETHOXYCARBONYL)-1H-1,2,3-TRIAZOL-5-YL]METHYL)AMINO)BENZOATE
英文同义词: ETHYL 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-5-([4-(ETHOXYCARBONYL)ANILINO]METHYL)-1H-1,2,3-TRIAZOLE-4-CARBOXYLATE ; ETHYL 4-(([1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-4-(ETHOXYCARBONYL)-1H-1,2,3-TRIAZOL-5-YL]METHYL)AMINO)BENZOATE
MDL号: MFCD01306267
氢键受体数量: 12
氢键供体数量: 2
Smile: CCOC(=O)c1ccc(cc1)NCc2c(nnn2c3c(non3)N)C(=O)OCC
InChi: InChI=1S/C17H19N7O5/c1-3-27-16(25)10-5-7-11(8-6-10)19-9-12-13(17(26)28-4-2)20-23-24(12)15-14(18)21-29-22-15/h5-8,19H,3-4,9H2,1-2H3,(H2,18,21)
InChiKey: InChIKey=VZALHWFVGPEZET-UHFFFAOYSA-N

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