HIT ID: HIT211998740
Cas No: 96034-64-9
分子式: C15H19N3O5S
分子量: 353.39
常用名: (2S,4S)-4-Nitrobenzyl 2-(dimethylcarbamoyl)-4-mercaptopyrrolidine-1-carboxylate
常用名: (2S,4S)-4-Nitrobenzyl 2-(dimethylcarbamoyl)-4-mercaptopyrrolidine-1-carboxylate
氢键受体数 (HBA): 4
氢键供体数 (HBD): 1
LogP: 1.3588989
IUPAC: (4-nitrophenyl)methyl (2S,4S)-2-(dimethylcarbamoyl)-4-sulfanylpyrrolidine-1-carboxylate
IUPAC: (4-nitrophenyl)methyl (2S,4S)-2-(dimethylcarbamoyl)-4-sulfanylpyrrolidine-1-carboxylate
SMILES: CN(C)C(=O)[C@@H]1C[C@H](S)CN1C(=O)OCc1ccc(cc1)[N+]([O-])=O
SMILES: CN(C)C(=O)[C@@H]1C[C@H](S)CN1C(=O)OCc1ccc(cc1)[N+]([O-])=O
InChI key: VGLBNJWGUYQZHD-STQMWFEESA-N
