N-BENZYL-N'-(3-(4-BR-PH)-5-THIOXO-1,5-DIHYDRO-4H-1,2,4-TRIAZOL-4-YL)THIOUREA

CAS号
539808-16-7
CCD编号
CCD00488686
分子式
C16 H14 Br N5 S2
分子量
420.358

基本信息

产品名称: N-BENZYL-N'-(3-(4-BR-PH)-5-THIOXO-1,5-DIHYDRO-4H-1,2,4-TRIAZOL-4-YL)THIOUREA
CAS: 539808-16-7
英文同义词: N-BENZYL-N'-(3-(4-BR-PH)-5-THIOXO-1,5-DIHYDRO-4H-1,2,4-TRIAZOL-4-YL)THIOUREA
MDL号: MFCD05154895
氢键受体数量: 5
氢键供体数量: 3
Smile: c1ccc(cc1)CNC(=S)Nn2c(n[nH]c2=S)c3ccc(cc3)Br
InChi: InChI=1S/C16H14BrN5S2/c17-13-8-6-12(7-9-13)14-19-20-16(24)22(14)21-15(23)18-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,20,24)(H2,18,21,23)
InChiKey: InChIKey=FMBUYXXEXPSPQS-UHFFFAOYSA-N

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