AURORA 21481

CAS号
CCD编号
CCD00482450
分子式
C22H18ClN3O3S
分子量
439.921

基本信息

产品名称: AURORA 21481
英文同义词: AURORA 21481
MDL号: MFCD05022949
氢键受体数量: 6
氢键供体数量: 1
Smile: COC1=C(NC(=O)CN2C=NC3=C(C(=C(C)S3)C3=CC=C(Cl)C=C3)C2=O)C=CC=C1
InChi: InChI=1S/C22H18ClN3O3S/c1-13-19(14-7-9-15(23)10-8-14)20-21(30-13)24-12-26(22(20)28)11-18(27)25-16-5-3-4-6-17(16)29-2/h3-10,12H,11H2,1-2H3,(H,25,27)
InChiKey: InChIKey=XSSXDLXEJWYDLS-UHFFFAOYSA-N

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