3-tert-butoxycarbonyl-7,9-dichloro-6-dimethylcarbamoylthio-2,3,4,5-tetrahydro-1H-benzo[d]azepine (HCID 57656277)

基本情報

標準SMILES: CN(C)C(=O)Sc1c(Cl)cc(Cl)c2c1CCN(C(=O)OC(C)(C)C)CC2
InChIKey: FDJDEZSXYKMORB-UHFFFAOYSA-N
分子式: C18H24Cl2N2O3S
平均分子量: 419.4 g/mol
単同位体質量: 418.0884692

名称と識別子

優先名称: 3-tert-butoxycarbonyl-7,9-dichloro-6-dimethylcarbamoylthio-2,3,4,5-tetrahydro-1H-benzo[d]azepine
IUPAC: tert-butyl 7,9-dichloro-6-(dimethylcarbamoylsulfanyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate

名称と別名

SCHEMBL506954FDJDEZSXYKMORB-UHFFFAOYSA-N3-tert-butoxycarbonyl-7,9-dichloro-6-dimethylcarbamoylthio-2,3,4,5-tetrahydro-1H-benzo[d]azepine3-tert-butoxycarbonyl-7,9-dichloro-6-dimethylcarbamoylthio-2,3,4,5-tetrahydro-benzo[d]azepine