HIT ID: HIT214316327
Cas No: 73857-20-2
分子式: C13H22N4O4S
分子量: 330.4
常用名: Ranitidine-N-oxide
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N,N-dimethyl-1-(5-{[(2-{[1-(methylamino)-2-nitroethenyl]amino}ethyl)sulfanyl]methyl}furan-2-yl)methanamine oxide
IUPAC: N,N-dimethyl-1-(5-{[(2-{[1-(methylamino)-2-nitroethenyl]amino}ethyl)sulfanyl]methyl}furan-2-yl)methanamine oxide
SMILES: CNC(NCCSCc1ccc(CN(C)(C)=O)o1)=CN(=O)=O |w:18.19|
SMILES: CNC(NCCSCc1ccc(CN(C)(C)=O)o1)=CN(=O)=O |w:18.19|
InChI key: DFJVUWAHTQPQCV-UHFFFAOYSA-N
