2-[p-(Cyanoacetylamino)-phenyl]-3,4-diaza-bicyclo[4.1.0]hept-2-en-5-one hemihydrate

HCID 70488698

基本情報

標準SMILES: N#CCC(=O)Nc1ccc(C2=NNC(=O)C3CC23)cc1.N#CCC(=O)Nc1ccc(C2=NNC(=O)C3CC23)cc1.O
InChIKey: VHFKOJFOKAASAV-UHFFFAOYSA-N
分子式: C28H26N8O5
平均分子量: 554.6 g/mol

優先名称: 2-[p-(Cyanoacetylamino)-phenyl]-3,4-diaza-bicyclo[4.1.0]hept-2-en-5-one hemihydrate
IUPAC: bis(2-cyano-N-[4-(5-oxo-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)phenyl]acetamide);hydrate

SCHEMBL10997598VHFKOJFOKAASAV-UHFFFAOYSA-N2-[p-(cyanoacetylamino)-phenyl]-3,4-diaza-bicyclo[4.1.0]hept-2-en-5-one hemihydrate

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