METHYL 4-[([[5-[(4-TERT-BUTYLPHENOXY)METHYL]-4-(4-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]ACETYL)AMINO]BENZOATE

CAS号
539812-19-6
CCD编号
CCD00391687
分子式
C30 H32 N4 O4 S
分子量
544.673

基本信息

产品名称: METHYL 4-[([[5-[(4-TERT-BUTYLPHENOXY)METHYL]-4-(4-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]ACETYL)AMINO]BENZOATE
CAS: 539812-19-6
英文同义词: METHYL 4-[([[5-[(4-TERT-BUTYLPHENOXY)METHYL]-4-(4-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]ACETYL)AMINO]BENZOATE
MDL号: MFCD03460881
氢键受体数量: 8
氢键供体数量: 1
Smile: Cc1ccc(cc1)n2c(nnc2SCC(=O)Nc3ccc(cc3)C(=O)OC)COc4ccc(cc4)C(C)(C)C
InChi: InChI=1S/C30H32N4O4S/c1-20-6-14-24(15-7-20)34-26(18-38-25-16-10-22(11-17-25)30(2,3)4)32-33-29(34)39-19-27(35)31-23-12-8-21(9-13-23)28(36)37-5/h6-17H,18-19H2,1-5H3,(H,31,35)
InChiKey: InChIKey=LWEJYSZOLGOZDU-UHFFFAOYSA-N

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