HIT ID: HIT214322604
Cas No: 1494684-33-1
分子式: C25H33F3N8O8S2
分子量: 694.7
常用名: CYH33 methanesulfonate
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: methanesulfonic acid; methyl N-(5-{6-[(4-methanesulfonylpiperazin-1-yl)methyl]-4-(morpholin-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-yl}-4-(trifluoromethyl)pyridin-2-yl)carbamate
IUPAC: methanesulfonic acid; methyl N-(5-{6-[(4-methanesulfonylpiperazin-1-yl)methyl]-4-(morpholin-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-yl}-4-(trifluoromethyl)pyridin-2-yl)carbamate
SMILES: CS(O)(=O)=O.COC(=O)Nc1cc(c(cn1)-c1nc(N2CCOCC2)c2cc(CN3CCN(CC3)S(C)(=O)=O)cn2n1)C(F)(F)F
SMILES: CS(O)(=O)=O.COC(=O)Nc1cc(c(cn1)-c1nc(N2CCOCC2)c2cc(CN3CCN(CC3)S(C)(=O)=O)cn2n1)C(F)(F)F
InChI key: CYWUJTNXNJVGLY-UHFFFAOYSA-N
