2-[[[[3-(4-CHLORO-3-NITROPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-5-IODO-BENZOIC ACID

CAS号
531520-06-6
CCD编号
CCD00396293
分子式
C17 H11 Cl I N3 O5 S
分子量
531.709

基本信息

产品名称: 2-[[[[3-(4-CHLORO-3-NITROPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-5-IODO-BENZOIC ACID
CAS: 531520-06-6
英文同义词: BENZOIC ACID, 2-[[[[3-(4-CHLORO-3-NITROPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-5-IODO- ; 2-[[[[3-(4-CHLORO-3-NITROPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-5-IODO-BENZOIC ACID
MDL号: MFCD03565792
氢键受体数量: 8
氢键供体数量: 3
Smile: c1cc(c(cc1/C=C/C(=O)NC(=S)Nc2ccc(cc2C(=O)O)I)[N+](=O)[O-])Cl
InChi: InChI=1S/C17H11ClIN3O5S/c18-12-4-1-9(7-14(12)22(26)27)2-6-15(23)21-17(28)20-13-5-3-10(19)8-11(13)16(24)25/h1-8H,(H,24,25)(H2,20,21,23,28)/b6-2+
InChiKey: InChIKey=GYOWNMSPJRAHRK-QHHAFSJGSA-N

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