N-(4-IODO-2-ISOPROPYLPHENYL)-2-([5-(4-METHOXYPHENYL)-4-METHYL-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)ACETAMIDE

CAS号
CCD编号
CCD00396363
分子式
C21 H23 I N4 O2 S
分子量
522.405

基本信息

产品名称: N-(4-IODO-2-ISOPROPYLPHENYL)-2-([5-(4-METHOXYPHENYL)-4-METHYL-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)ACETAMIDE
英文同义词: N-(4-IODO-2-ISOPROPYLPHENYL)-2-([5-(4-METHOXYPHENYL)-4-METHYL-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)ACETAMIDE
MDL号: MFCD03566424
氢键受体数量: 6
氢键供体数量: 1
Smile: CC(C)c1cc(ccc1NC(=O)CSc2nnc(n2C)c3ccc(cc3)OC)I
InChi: InChI=1S/C21H23IN4O2S/c1-13(2)17-11-15(22)7-10-18(17)23-19(27)12-29-21-25-24-20(26(21)3)14-5-8-16(28-4)9-6-14/h5-11,13H,12H2,1-4H3,(H,23,27)
InChiKey: InChIKey=BRSNIKVOHPWHLY-UHFFFAOYSA-N

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