4,5,6,7-四氢-3-苯基-1H-吲唑

CAS号
222400-20-6
CCD编号
CCD00898906
分子式
C23 H35 N7 O6 S
分子量
537.638

基本信息

产品名称: 4,5,6,7-四氢-3-苯基-1H-吲唑
CAS: 222400-20-6
中文同义词: 4,5,6,7-四氢-3-苯基-1H-吲唑
英文同义词: TOMOPENEM
MDL号: MFCD09954150
氢键受体数量: 13
氢键供体数量: 6
Smile: C[C@@H]1[C@@H]2[C@H](C(=O)N2C(=C1S[C@H]3C[C@H](N(C3)C)C(=O)N4CCC[C@@H]4NC(=O)CNC(=N)N)C(=O)O)[C@@H](C)O
InChi: InChI=1S/C23H35N7O6S/c1-10-17-16(11(2)31)21(34)30(17)18(22(35)36)19(10)37-12-7-13(28(3)9-12)20(33)29-6-4-5-14(29)27-15(32)8-26-23(24)25/h10-14,16-17,31H,4-9H2,1-3H3,(H,27,32)(H,35,36)(H4,24,25,26)/t10-,11-,12+,13+,14-,16-,17-/m1/s1
InChiKey: InChIKey=HXSRKROQMFKEAR-ORPMZVJSSA-N

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