1-(5-(3,4-DIMETHOXYPHENYL)TETRAZOL-2-YLACETYL)-4-(4-ETHOXYPHENYL)THIOSEMICARBAZIDE

CAS号
94771-98-9
CCD编号
CCD00239912
分子式
C20 H23 N7 O4 S
分子量
457.513

基本信息

产品名称: 1-(5-(3,4-DIMETHOXYPHENYL)TETRAZOL-2-YLACETYL)-4-(4-ETHOXYPHENYL)THIOSEMICARBAZIDE
CAS: 94771-98-9
英文同义词: 1-(5-(3,4-DIMETHOXYPHENYL)TETRAZOL-2-YLACETYL)-4-(4-ETHOXYPHENYL)THIOSEMICARBAZIDE
MDL号: MFCD01682618
氢键受体数量: 11
氢键供体数量: 3
Smile: CCOc1ccc(cc1)NC(=S)NNC(=O)Cn2nc(nn2)c3ccc(c(c3)OC)OC
InChi: InChI=1S/C20H23N7O4S/c1-4-31-15-8-6-14(7-9-15)21-20(32)24-22-18(28)12-27-25-19(23-26-27)13-5-10-16(29-2)17(11-13)30-3/h5-11H,4,12H2,1-3H3,(H,22,28)(H2,21,24,32)
InChiKey: InChIKey=OEYCFBCKOWTNRW-UHFFFAOYSA-N

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