HIT ID: HIT219250693
Cas No: 1646361-04-7
分子式: C22H26BrFN4O6S2
分子量: 605.49
常用名: Morphothiadin mesylate
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: ethyl 6-(2-bromo-4-fluorophenyl)-4-[(morpholin-4-yl)methyl]-2-(1,3-thiazol-2-yl)-1,6-dihydropyrimidine-5-carboxylate; methanesulfonic acid
IUPAC: ethyl 6-(2-bromo-4-fluorophenyl)-4-[(morpholin-4-yl)methyl]-2-(1,3-thiazol-2-yl)-1,6-dihydropyrimidine-5-carboxylate; methanesulfonic acid
SMILES: CS(O)(=O)=O.CCOC(=O)C1=C(CN2CCOCC2)N=C(NC1c1ccc(F)cc1Br)c1nccs1
SMILES: CS(O)(=O)=O.CCOC(=O)C1=C(CN2CCOCC2)N=C(NC1c1ccc(F)cc1Br)c1nccs1
InChI key: FDMKMKYZDJHHFM-UHFFFAOYSA-N
